Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:21:57 UTC |
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Update Date | 2025-03-21 18:37:18 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00115065 |
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Frequency | 22.9 |
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Structure | |
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Chemical Formula | C13H18N2O |
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Molecular Mass | 218.1419 |
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SMILES | CC(=O)N1CCN(c2ccccc2C)CC1 |
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InChI Key | JBTQRFMTDYRGLH-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organoheterocyclic compounds |
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Class | diazinanes |
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Subclass | piperazines |
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Direct Parent | phenylpiperazines |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | acetamidesamino acids and derivativesaminotoluenesaniline and substituted anilinesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesdialkylarylamineshydrocarbon derivativesn-arylpiperazinesorganic oxidesorganopnictogen compoundstertiary carboxylic acid amides |
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Substituents | monocyclic benzene moietycarbonyl grouparomatic heteromonocyclic compoundamino acid or derivativescarboxylic acid derivativeorganic oxidetertiary aliphatic/aromatic aminetertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compounddialkylarylaminetertiary amineacetamideaminotolueneazacycleaniline or substituted anilinescarboxamide groupphenylpiperazineorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundtolueneaminen-arylpiperazineorganooxygen compound |
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