N-Benzyldinicotinoylamine
Basic information
- CAS
7252-85-9- Standard SMILES
O=C(c1cccnc1)N(Cc1ccccc1)C(=O)c1cccnc1- InChIKey
UVXQDNULVCVJKZ-UHFFFAOYSA-N- Molecular formula
- C19H15N3O2
- Average molar mass
- 317.3 g/mol
- Monoisotopic mass
- 317.11642673
Names & identifiers
- Preferred name
- N-Benzyldinicotinoylamine
- IUPAC
- N-benzyl-N-(pyridine-3-carbonyl)pyridine-3-carboxamide
- English name
- N-Benzyl-N-nicotinoylnicotinamide
- Molecular formula
- C19H15N3O2
- Molecular weight
- 317.3413
Names & synonyms
7252-85-9N-BenzyldinicotinoylamineN-benzyl-N-(pyridine-3-carbonyl)pyridine-3-carboxamideN-BENZYL-N-NICOTINOYLNICOTINAMIDEMLS002693880NSC-73729NSC73729EINECS 230-671-7TKQ8CG7CCYDinicotinamide, N-benzyl-Oprea1_581469SCHEMBL9104852
Show more names
N-Phenylmethyl-N-(3-pyridinylcarbonyl)-3-pyridinecarboxamide3-Pyridinecarboxamide, N-(phenylmethyl)-N-(3-pyridinylcarbonyl)-
CHEMBL1887050DTXSID60222847UVXQDNULVCVJKZ-UHFFFAOYSA-NHMS3094G11NSC 73729SMR001559821DB-055648NS00037381
Database identifiers
- CAS
7252-85-9- PubChem CID
- 81674
- DTXSID
DTXSID60222847- ChEMBL
CHEMBL1887050- UNII
- TKQ8CG7CCY
- EC Number
- 230-671-7
- Nikkaji
- J212.266I
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 63.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 404
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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