Mls003171110
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Basic information
- CAS
49807-92-3- Standard SMILES
O=C(NCCNC(=O)c1cccnc1)c1cccnc1- InChIKey
RHJVAHPSSQKDOI-UHFFFAOYSA-N- Molecular formula
- C14H14N4O2
- Average molar mass
- 270.29 g/mol
- Monoisotopic mass
- 270.1116757
Names & identifiers
- Preferred name
- Mls003171110
- IUPAC
- N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-3-carboxamide
Names & synonyms
49807-92-3MLS003171110DTXSID60319928RefChem:357345DTXCID00271051N-[2-(pyridine-3-carbonylamino)ethyl]pyridine-3-carboxamideNSC351891CBMicro_015068CHEMBL2133698SCHEMBL25328235N,N'-1,2-ethanediyldinicotinamideN,N'-Ethane-1,2-diyldinicotinamide
Show more names
N-{2-[(PYRIDIN-3-YL)FORMAMIDO]ETHYL}PYRIDINE-3-CARBOXAMIDESTK988115AKOS000548991N,N'-(ethane-1,2-diyl)dinicotinamideNSC-351891NCGC00674553-01SMR001875018BIM-0015296.P001
Database identifiers
- CAS
49807-92-3- PubChem CID
- 336744
- DTXSID
DTXSID60319928- ChEMBL
CHEMBL2133698- Nikkaji
- J1.240.741F
Properties
Computed structural propertiesFilling in
- XLogP
- 0.5
- Topological polar surface area
- 84 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 303
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Related reactions
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Compound notes
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