4-(4-Methylphenyl)piperazine-1-carboxamide
Basic information
- CAS
85474-81-3- Standard SMILES
Cc1ccc(N2CCN(C(N)=O)CC2)cc1- InChIKey
RPGNTUSRXJXNEC-UHFFFAOYSA-N- Molecular formula
- C12H17N3O
- Average molar mass
- 219.28 g/mol
- Monoisotopic mass
- 219.13716217
Names & identifiers
- Preferred name
- 4-(4-Methylphenyl)piperazine-1-carboxamide
- IUPAC
- 4-(4-methylphenyl)piperazine-1-carboxamide
Names & synonyms
85474-81-34-(4-methylphenyl)piperazine-1-carboxamide4-(p-Tolyl)piperazine-1-carboxamideNSC87106NCIOpen2_005177SCHEMBL9410734DTXSID60293072NSC-87106AKOS0305474464-(4-methylphenyl)-1-piperazinecarboxamideAQ-360/42570611Z1509441355
Database identifiers
- CAS
85474-81-3- PubChem CID
- 258307
- DTXSID
DTXSID60293072
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 49.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 241
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Compound notes
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