4-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine

C8H6F3N3S — CID 28812038

IUPAC4-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine
SMILESNc1n[nH]c(C(F)(F)F)c1-c1cccs1
InChIInChI=1S/C8H6F3N3S/c9-8(10,11)6-5(7(12)14-13-6)4-2-1-3-15-4/h1-3H,(H3,12,13,14)
InChIKeyCFFNYBLQRHIDJN-UHFFFAOYSA-N
MW233.22 g/mol
LogP2.74
Rot. Bonds1

About 4-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine

4-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine (PubChem CID 28812038) has the molecular formula C8H6F3N3S and a molecular weight of 233.22 g/mol. Its IUPAC name is 4-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name4-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine
PubChem CID28812038
Molecular FormulaC8H6F3N3S
Molecular Weight233.22 g/mol
Exact Mass233.02
IUPAC Name4-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine
SMILESNc1n[nH]c(C(F)(F)F)c1-c1cccs1
InChIInChI=1S/C8H6F3N3S/c9-8(10,11)6-5(7(12)14-13-6)4-2-1-3-15-4/h1-3H,(H3,12,13,14)
InChIKeyCFFNYBLQRHIDJN-UHFFFAOYSA-N
XLogP2.74
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.22
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-thiophen-2-yl-5-(trifluoromethyl)-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-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
The IUPAC name of 4-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine (CID 28812038) is 4-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine.
What is the SMILES notation for 4-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
The canonical SMILES for 4-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine is Nc1n[nH]c(C(F)(F)F)c1-c1cccs1.
What is the InChIKey of 4-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
The InChIKey is CFFNYBLQRHIDJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F3N3S/c9-8(10,11)6-5(7(12)14-13-6)4-2-1-3-15-4/h1-3H,(H3,12,13,14).
What are the key properties of 4-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
4-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine has a molecular weight of 233.22 g/mol, XLogP of 2.74, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-thiophen-2-yl-5-(trifluoromethyl)-1H-pyrazol-3-amine is sourced from PubChem (CID 28812038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).