5-(Pyrimidin-2-yl)nicotinamide
Basic information
- CAS
1356111-09-5- Standard SMILES
NC(=O)c1cncc(-c2ncccn2)c1- InChIKey
BMRAQLUFSDJMNV-UHFFFAOYSA-N- Molecular formula
- C10H8N4O
- Average molar mass
- 200.2 g/mol
- Monoisotopic mass
- 200.06981089
Names & identifiers
- Preferred name
- 5-(Pyrimidin-2-yl)nicotinamide
- IUPAC
- 5-pyrimidin-2-ylpyridine-3-carboxamide
Names & synonyms
5-(Pyrimidin-2-yl)nicotinamide1356111-09-55-(pyrimidin-2-yl)pyridine-3-carboxamideDTXSID10745051
Database identifiers
- CAS
1356111-09-5- PubChem CID
- 71303602
- DTXSID
DTXSID10745051
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 81.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 227
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Compound notes
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