2-(2-chlorophenyl)-5-methylpyrazol-3-amine

C10H10ClN3 — CID 7176319

IUPAC2-(2-chlorophenyl)-5-methylpyrazol-3-amine
SMILESCc1cc(N)n(-c2ccccc2Cl)n1
InChIInChI=1S/C10H10ClN3/c1-7-6-10(12)14(13-7)9-5-3-2-4-8(9)11/h2-6H,12H2,1H3
InChIKeyNEKHWUVVKRUUIT-UHFFFAOYSA-N
MW207.66 g/mol
LogP2.42
Rot. Bonds1

About 2-(2-chlorophenyl)-5-methylpyrazol-3-amine

2-(2-chlorophenyl)-5-methylpyrazol-3-amine (PubChem CID 7176319) has the molecular formula C10H10ClN3 and a molecular weight of 207.66 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-5-methylpyrazol-3-amine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-5-methylpyrazol-3-amine
PubChem CID7176319
Molecular FormulaC10H10ClN3
Molecular Weight207.66 g/mol
Exact Mass207.06
IUPAC Name2-(2-chlorophenyl)-5-methylpyrazol-3-amine
SMILESCc1cc(N)n(-c2ccccc2Cl)n1
InChIInChI=1S/C10H10ClN3/c1-7-6-10(12)14(13-7)9-5-3-2-4-8(9)11/h2-6H,12H2,1H3
InChIKeyNEKHWUVVKRUUIT-UHFFFAOYSA-N
XLogP2.42
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.66
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-5-methylpyrazol-3-amine?
The IUPAC name of 2-(2-chlorophenyl)-5-methylpyrazol-3-amine (CID 7176319) is 2-(2-chlorophenyl)-5-methylpyrazol-3-amine.
What is the SMILES notation for 2-(2-chlorophenyl)-5-methylpyrazol-3-amine?
The canonical SMILES for 2-(2-chlorophenyl)-5-methylpyrazol-3-amine is Cc1cc(N)n(-c2ccccc2Cl)n1.
What is the InChIKey of 2-(2-chlorophenyl)-5-methylpyrazol-3-amine?
The InChIKey is NEKHWUVVKRUUIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3/c1-7-6-10(12)14(13-7)9-5-3-2-4-8(9)11/h2-6H,12H2,1H3.
What are the key properties of 2-(2-chlorophenyl)-5-methylpyrazol-3-amine?
2-(2-chlorophenyl)-5-methylpyrazol-3-amine has a molecular weight of 207.66 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-5-methylpyrazol-3-amine is sourced from PubChem (CID 7176319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).