1-(3-chlorophenyl)-5-methyl-4,5-dihydro-1H-pyrazol-3-amine

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Basic information

CAS: 77992-31-5
Standard SMILES: CC1CC(N)=NN1c1cccc(Cl)c1
InChIKey: CBBMDRWTCCWIAE-UHFFFAOYSA-N
Molecular formula: C10H12ClN3
Average molar mass: 209.67 g/mol
Monoisotopic mass: 209.0719751

Names & identifiers

Preferred name: 1-(3-chlorophenyl)-5-methyl-4,5-dihydro-1H-pyrazol-3-amine
IUPAC: 2-(3-chlorophenyl)-3-methyl-3,4-dihydropyrazol-5-amine
English name: 1-(3-chlorophenyl)-5-methyl-4,5-dihydro-1H-pyrazol-3-amine
Molecular formula: C10H12ClN3
Molecular weight: 209.68

Names & synonyms

77992-31-51-(3-chlorophenyl)-5-methyl-4,5-dihydro-1H-pyrazol-3-amineSCHEMBL908054DTXSID101192885DA-028451-(3-Chlorophenyl)-4,5-dihydro-5-methyl-1H-pyrazol-3-amine1H-Pyrazol-3-amine, 1-(3-chlorophenyl)-4,5-dihydro-5-methyl-

Database identifiers

CAS: 77992-31-5
PubChem CID: 13563131
DTXSID: DTXSID101192885

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 41.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 14
Formal charge: 0
Complexity: 242

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