Basic information
- CAS
63873-92-7- Standard SMILES
c1ccc(NCn2cnc3ccccc32)cc1- InChIKey
XEVXPIRXOWDVKA-UHFFFAOYSA-N- Molecular formula
- C14H13N3
- Average molar mass
- 223.27 g/mol
- Monoisotopic mass
- 223.11094743
Names & identifiers
- Preferred name
- N-(1H-Benzimidazol-1-ylmethyl)aniline
- IUPAC
- N-(benzimidazol-1-ylmethyl)aniline
Names & synonyms
N-(1H-Benzimidazol-1-ylmethyl)anilineNSC617417N-(benzimidazol-1-ylmethyl)anilineOprea1_702972CHEMBL1979073AKOS003627414NSC-617417NCI60_005255N-(1H-Benzimidazol-1-ylmethyl)-N-phenylamine
Database identifiers
- CAS
63873-92-7- PubChem CID
- 357883
- ChEMBL
CHEMBL1979073- EC Number
- 132-218-8
- Nikkaji
- J874.634F
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 29.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 238
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…