4-Pyridinecarboxamide, N-(4-pyridinylmethyl)-
Basic information
- CAS
28489-58-9- Standard SMILES
O=C(NCc1ccncc1)c1ccncc1- InChIKey
AQVNQXCOBGHOPL-UHFFFAOYSA-N- Molecular formula
- C12H11N3O
- Average molar mass
- 213.23 g/mol
- Monoisotopic mass
- 213.09021198
Names & identifiers
- Preferred name
- 4-Pyridinecarboxamide, N-(4-pyridinylmethyl)-
- IUPAC
- N-(pyridin-4-ylmethyl)pyridine-4-carboxamide
- English name
- 4-pmia
- Molecular formula
- C12H11N3O
- Molecular weight
- 213.24
Names & synonyms
28489-58-94-Pyridinecarboxamide, N-(4-pyridinylmethyl)-DTXSID60355644RefChem:296027DTXCID30306704N-(pyridin-4-ylmethyl)pyridine-4-carboxamideN-(pyridin-4-ylmethyl)isonicotinamide4-pyridinecarboxamide,n-(4-pyridinylmethyl)-N-[(pyridin-4-yl)methyl]pyridine-4-carboxamideOprea1_172626Oprea1_290284Apatinib Mesylate Impurity 7
Show more names
4-pmia4-pyridylmethylisonicotinamide
SCHEMBL1569157N-(4-Pyridylmethyl)isonicotinamideMFCD00778004AKOS003855997SY460313AG-690/11032009SR-01000358010SR-01000358010-1
Database identifiers
- CAS
28489-58-9- PubChem CID
- 811490
- DTXSID
DTXSID60355644- Nikkaji
- J1.269.715E
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 54.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 220
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Related reactions
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Compound notes
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