4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine

C8H9N3S — CID 3159690

IUPAC4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine
SMILESCc1c(N)n[nH]c1-c1cccs1
InChIInChI=1S/C8H9N3S/c1-5-7(10-11-8(5)9)6-3-2-4-12-6/h2-4H,1H3,(H3,9,10,11)
InChIKeyQNJRKFJFJHKCLE-UHFFFAOYSA-N
MW179.25 g/mol
LogP2.03
Rot. Bonds1

About 4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine

4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine (PubChem CID 3159690) has the molecular formula C8H9N3S and a molecular weight of 179.25 g/mol. Its IUPAC name is 4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine
PubChem CID3159690
Molecular FormulaC8H9N3S
Molecular Weight179.25 g/mol
Exact Mass179.05
IUPAC Name4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine
SMILESCc1c(N)n[nH]c1-c1cccs1
InChIInChI=1S/C8H9N3S/c1-5-7(10-11-8(5)9)6-3-2-4-12-6/h2-4H,1H3,(H3,9,10,11)
InChIKeyQNJRKFJFJHKCLE-UHFFFAOYSA-N
XLogP2.03
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.25
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-methyl-5-thiophen-2-yl-1H-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

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine?
The IUPAC name of 4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine (CID 3159690) is 4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine.
What is the SMILES notation for 4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine?
The canonical SMILES for 4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine is Cc1c(N)n[nH]c1-c1cccs1.
What is the InChIKey of 4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine?
The InChIKey is QNJRKFJFJHKCLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3S/c1-5-7(10-11-8(5)9)6-3-2-4-12-6/h2-4H,1H3,(H3,9,10,11).
What are the key properties of 4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine?
4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine has a molecular weight of 179.25 g/mol, XLogP of 2.03, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-thiophen-2-yl-1H-pyrazol-3-amine is sourced from PubChem (CID 3159690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).