3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride

C5H8ClF2N3 — CID 71757824

IUPAC3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride
SMILESCc1[nH]nc(C(F)F)c1N.Cl
InChIInChI=1S/C5H7F2N3.ClH/c1-2-3(8)4(5(6)7)10-9-2;/h5H,8H2,1H3,(H,9,10);1H
InChIKeyIDTZXEIWXSSPQF-UHFFFAOYSA-N
MW183.59 g/mol
LogP1.66
Rot. Bonds1

About 3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride

3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride (PubChem CID 71757824) has the molecular formula C5H8ClF2N3 and a molecular weight of 183.59 g/mol. Its IUPAC name is 3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride.

Molecular Properties

Compound Name3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride
PubChem CID71757824
Molecular FormulaC5H8ClF2N3
Molecular Weight183.59 g/mol
Exact Mass183.04
IUPAC Name3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride
SMILESCc1[nH]nc(C(F)F)c1N.Cl
InChIInChI=1S/C5H7F2N3.ClH/c1-2-3(8)4(5(6)7)10-9-2;/h5H,8H2,1H3,(H,9,10);1H
InChIKeyIDTZXEIWXSSPQF-UHFFFAOYSA-N
XLogP1.66
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.59
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride?
The IUPAC name of 3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride (CID 71757824) is 3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride.
What is the SMILES notation for 3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride?
The canonical SMILES for 3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride is Cc1[nH]nc(C(F)F)c1N.Cl.
What is the InChIKey of 3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride?
The InChIKey is IDTZXEIWXSSPQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7F2N3.ClH/c1-2-3(8)4(5(6)7)10-9-2;/h5H,8H2,1H3,(H,9,10);1H.
What are the key properties of 3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride?
3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride has a molecular weight of 183.59 g/mol, XLogP of 1.66, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethyl)-5-methyl-1H-pyrazol-4-amine;hydrochloride is sourced from PubChem (CID 71757824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).