2-Amino-4,5-dimethyl-1-phenyl-1H-pyrrole-3-carboxamide
Basic information
- CAS
106105-29-7- Standard SMILES
Cc1c(C(N)=O)c(N)n(-c2ccccc2)c1C- InChIKey
KVOUXHULATZVIJ-UHFFFAOYSA-N- Molecular formula
- C13H15N3O
- Average molar mass
- 229.28 g/mol
- Monoisotopic mass
- 229.12151211
Names & identifiers
- Preferred name
- 2-Amino-4,5-dimethyl-1-phenyl-1H-pyrrole-3-carboxamide
- IUPAC
- 2-amino-4,5-dimethyl-1-phenylpyrrole-3-carboxamide
Names & synonyms
106105-29-72-Amino-4,5-dimethyl-1-phenyl-1H-pyrrole-3-carboxamideDTXSID10545538
Database identifiers
- CAS
106105-29-7- PubChem CID
- 13635176
- DTXSID
DTXSID10545538- Nikkaji
- J703.530F
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 74 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 288
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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