Basic information
- CAS
95834-36-9- Standard SMILES
NCc1cnn(-c2ccccc2)c1-n1cccc1- InChIKey
CBOZFDRDDSJOPV-UHFFFAOYSA-N- Molecular formula
- C14H14N4
- Average molar mass
- 238.29 g/mol
- Monoisotopic mass
- 238.12184646
Names & identifiers
- Preferred name
- (1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl)methanamine
- IUPAC
- (1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)methanamine
Names & synonyms
(1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl)methanamine95834-36-9(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)methanamineDTXSID401213545AKOS024134044F2158-23401-Phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-methanamine1-[1-Phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanamine
Database identifiers
- CAS
95834-36-9- PubChem CID
- 13409751
- DTXSID
DTXSID401213545
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 48.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 259
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…