1-(2-chlorophenyl)pyrazol-3-amine

C9H8ClN3 — CID 23464287

IUPAC1-(2-chlorophenyl)pyrazol-3-amine
SMILESNc1ccn(-c2ccccc2Cl)n1
InChIInChI=1S/C9H8ClN3/c10-7-3-1-2-4-8(7)13-6-5-9(11)12-13/h1-6H,(H2,11,12)
InChIKeySDVLYOOTZZBLCN-UHFFFAOYSA-N
MW193.64 g/mol
LogP2.11
Rot. Bonds1

About 1-(2-chlorophenyl)pyrazol-3-amine

1-(2-chlorophenyl)pyrazol-3-amine (PubChem CID 23464287) has the molecular formula C9H8ClN3 and a molecular weight of 193.64 g/mol. Its IUPAC name is 1-(2-chlorophenyl)pyrazol-3-amine.

Molecular Properties

Compound Name1-(2-chlorophenyl)pyrazol-3-amine
PubChem CID23464287
Molecular FormulaC9H8ClN3
Molecular Weight193.64 g/mol
Exact Mass193.04
IUPAC Name1-(2-chlorophenyl)pyrazol-3-amine
SMILESNc1ccn(-c2ccccc2Cl)n1
InChIInChI=1S/C9H8ClN3/c10-7-3-1-2-4-8(7)13-6-5-9(11)12-13/h1-6H,(H2,11,12)
InChIKeySDVLYOOTZZBLCN-UHFFFAOYSA-N
XLogP2.11
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.64
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-chlorophenyl)pyrazol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-Amino-1-(4-chlorophenyl)-1H-pyrazole-4-carbonitrile
CID 639097
1-Phenylpyrazol-5-ylamine
CID 70006
5-Amino-1-(3-chlorophenyl)-1H-pyrazole-4-carbonitrile
CID 734496
1-phenyl-1H-pyrazol-3-amine
CID 594320
1H-pyrazole-4-carbonitrile, 5-amino-1-(2,4-dichlorophenyl)-
CID 173645
1-[(3-Chlorophenyl)methyl]-1H-pyrazol-3-amine
CID 16195077
1-(2-chlorophenyl)-4-(1H-1,2,3,4-tetraazol-5-yl)-1H-pyrazol-3-amine
CID 2806140
1-(2,4-Dichlorophenyl)-3-(1-methyl-3-pyrazolyl)urea
CID 970792
5-Amino-1-(2-chlorophenyl)-1H-pyrazole-4-carbonitrile
CID 12366038
1-(3-chlorophenyl)-1H-pyrazole
CID 12238133
4-Chloro-1-phenylpyrazole
CID 601137
Pyrazole, 3-(dimethylamino)-1-phenyl-
CID 209328

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)pyrazol-3-amine?
The IUPAC name of 1-(2-chlorophenyl)pyrazol-3-amine (CID 23464287) is 1-(2-chlorophenyl)pyrazol-3-amine.
What is the SMILES notation for 1-(2-chlorophenyl)pyrazol-3-amine?
The canonical SMILES for 1-(2-chlorophenyl)pyrazol-3-amine is Nc1ccn(-c2ccccc2Cl)n1.
What is the InChIKey of 1-(2-chlorophenyl)pyrazol-3-amine?
The InChIKey is SDVLYOOTZZBLCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClN3/c10-7-3-1-2-4-8(7)13-6-5-9(11)12-13/h1-6H,(H2,11,12).
What are the key properties of 1-(2-chlorophenyl)pyrazol-3-amine?
1-(2-chlorophenyl)pyrazol-3-amine has a molecular weight of 193.64 g/mol, XLogP of 2.11, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)pyrazol-3-amine is sourced from PubChem (CID 23464287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).