Basic information
- CAS
4778-75-0- Standard SMILES
O=C(Nc1ccccc1)c1ccc[nH]1- InChIKey
MZPAQCAPWLAKSD-UHFFFAOYSA-N- Molecular formula
- C11H10N2O
- Average molar mass
- 186.21 g/mol
- Monoisotopic mass
- 186.07931295
Names & identifiers
- Preferred name
- N-phenyl-1H-pyrrole-2-carboxamide
- IUPAC
- N-phenyl-1H-pyrrole-2-carboxamide
Names & synonyms
N-phenyl-1H-pyrrole-2-carboxamide4778-75-01H-Pyrrole-2-carboxamide, N-phenyl-anilinoformylpyrrolepyrrole inhibitor 8Q6W9CWY6XAMLS000701844CHEMBL376643SCHEMBL4954697BDBM15582MZPAQCAPWLAKSD-UHFFFAOYSA-NHMS2596O19
Show more names
HMS3379I18AKOS009019552SMR000226375DB-087205MLS000701844-02AG-777/36177049
Database identifiers
- CAS
4778-75-0- PubChem CID
- 899774
- ChEMBL
CHEMBL376643- UNII
- Q6W9CWY6XA
- EC Number
- 194-309-9
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 44.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 199
Related reactions
2 records
Compound notes
Loading…