2-(4-Phenylpiperazin-1-yl)pyridine-3-carboxamide
Basic information
- CAS
101512-13-4- Standard SMILES
NC(=O)c1cccnc1N1CCN(c2ccccc2)CC1- InChIKey
VCFCMWMCSSSRPU-UHFFFAOYSA-N- Molecular formula
- C16H18N4O
- Average molar mass
- 282.34 g/mol
- Monoisotopic mass
- 282.14806121
Names & identifiers
- Preferred name
- 2-(4-Phenylpiperazin-1-yl)pyridine-3-carboxamide
- IUPAC
- 2-(4-phenylpiperazin-1-yl)pyridine-3-carboxamide
Names & synonyms
2-(4-phenylpiperazin-1-yl)pyridine-3-carboxamideOprea1_668115Oprea1_786987DTXSID101229933STK370482AKOS005446386101512-13-4ST509871212-(4-phenylpiperazinyl)pyridine-3-carboxamide3-Pyridinecarboxamide, 2-(4-phenyl-1-piperazinyl)-
Database identifiers
- CAS
101512-13-4- PubChem CID
- 831228
- DTXSID
DTXSID101229933
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 62.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 348
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Compound notes
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