1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine

C10H10FN3S — CID 163635787

IUPAC1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine
SMILESCSc1ccc(-n2ccc(N)n2)c(F)c1
InChIInChI=1S/C10H10FN3S/c1-15-7-2-3-9(8(11)6-7)14-5-4-10(12)13-14/h2-6H,1H3,(H2,12,13)
InChIKeyHZZREDXXOSQANB-UHFFFAOYSA-N
MW223.28 g/mol
LogP2.32
Rot. Bonds2

About 1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine

1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine (PubChem CID 163635787) has the molecular formula C10H10FN3S and a molecular weight of 223.28 g/mol. Its IUPAC name is 1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine.

Molecular Properties

Compound Name1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine
PubChem CID163635787
Molecular FormulaC10H10FN3S
Molecular Weight223.28 g/mol
Exact Mass223.06
IUPAC Name1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine
SMILESCSc1ccc(-n2ccc(N)n2)c(F)c1
InChIInChI=1S/C10H10FN3S/c1-15-7-2-3-9(8(11)6-7)14-5-4-10(12)13-14/h2-6H,1H3,(H2,12,13)
InChIKeyHZZREDXXOSQANB-UHFFFAOYSA-N
XLogP2.32
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2-fluoro-4-methylsulfanylphenyl)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 1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine?
The IUPAC name of 1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine (CID 163635787) is 1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine.
What is the SMILES notation for 1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine?
The canonical SMILES for 1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine is CSc1ccc(-n2ccc(N)n2)c(F)c1.
What is the InChIKey of 1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine?
The InChIKey is HZZREDXXOSQANB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3S/c1-15-7-2-3-9(8(11)6-7)14-5-4-10(12)13-14/h2-6H,1H3,(H2,12,13).
What are the key properties of 1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine?
1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine has a molecular weight of 223.28 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-4-methylsulfanylphenyl)pyrazol-3-amine is sourced from PubChem (CID 163635787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).