Basic information
- CAS
175544-08-8- Standard SMILES
Cn1ccc(C(N)=O)c1- InChIKey
ADBKBBXQJATDDG-UHFFFAOYSA-N- Molecular formula
- C6H8N2O
- Average molar mass
- 124.14 g/mol
- Monoisotopic mass
- 124.06366288
Names & identifiers
- Preferred name
- 1-Methyl-1h-pyrrole-3-carboxamide
- IUPAC
- 1-methylpyrrole-3-carboxamide
- English name
- 1H-Pyrrole-3-carboxamide,1-methyl-(9CI)
- Molecular formula
- C6H8N2O
- Molecular weight
- 124.14052
Names & synonyms
1-methyl-1h-pyrrole-3-carboxamide175544-08-81H-Pyrrole-3-carboxamide, 1-methyl-1-methylpyrrole-3-carboxamide1H-Pyrrole-3-carboxamide,1-methyl-(9CI)SCHEMBL5062781AKOS006352399DB-268243
Database identifiers
- CAS
175544-08-8- PubChem CID
- 22713735
- Nikkaji
- J1.955.454F
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 48 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 124
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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