N,2-Dimethyl-5-benzimidazolecarboxamide
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Basic information
- CAS
93690-15-4- Standard SMILES
CNC(=O)c1ccc2nc(C)[nH]c2c1- InChIKey
QVBIITZDJUZJPL-UHFFFAOYSA-N- Molecular formula
- C10H11N3O
- Average molar mass
- 189.21 g/mol
Names & identifiers
- Preferred name
- N,2-Dimethyl-5-benzimidazolecarboxamide
- IUPAC
- N,2-dimethyl-3H-benzimidazole-5-carboxamide
- English name
- 5(Or6)-Benzimidazolecarboxamide,N,2-dimethyl-(7CI)
- Molecular formula
- C10H11N3O
- Molecular weight
- 189.21
Names & synonyms
N,2-Dimethyl-5-benzimidazolecarboxamide93690-15-4SCHEMBL12430882SCHEMBL13306080QVBIITZDJUZJPL-UHFFFAOYSA-NN,2-Dimethyl-1H-benzimidazole-5-carboxamide #N,2-dimethyl-1H-benzo[d]imidazole-6-carboxamide1H-Benzimidazole-6-carboxamide, N,2-dimethyl-5(Or6)-Benzimidazolecarboxamide,N,2-dimethyl-(7CI)
Database identifiers
- CAS
93690-15-4- Nikkaji
- J1.396.104B
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 57.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 231
Physicochemical properties
- Boiling point
- 542.5 · 542.5±23.0 °C(Predicted)
- Density
- 1.247 · 1.247±0.06 g/cm3(Predicted)
- pka
- 10.98 · 10.98±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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