5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine

C9H8F3N3S — CID 22288393

IUPAC5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine
SMILESCn1nc(C(F)(F)F)cc1-c1ccc(N)s1
InChIInChI=1S/C9H8F3N3S/c1-15-5(6-2-3-8(13)16-6)4-7(14-15)9(10,11)12/h2-4H,13H2,1H3
InChIKeyYGZGZZMUUJBDOC-UHFFFAOYSA-N
MW247.25 g/mol
LogP2.75
Rot. Bonds1

About 5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine

5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine (PubChem CID 22288393) has the molecular formula C9H8F3N3S and a molecular weight of 247.25 g/mol. Its IUPAC name is 5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine.

Molecular Properties

Compound Name5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine
PubChem CID22288393
Molecular FormulaC9H8F3N3S
Molecular Weight247.25 g/mol
Exact Mass247.04
IUPAC Name5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine
SMILESCn1nc(C(F)(F)F)cc1-c1ccc(N)s1
InChIInChI=1S/C9H8F3N3S/c1-15-5(6-2-3-8(13)16-6)4-7(14-15)9(10,11)12/h2-4H,13H2,1H3
InChIKeyYGZGZZMUUJBDOC-UHFFFAOYSA-N
XLogP2.75
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.25
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-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 5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine?
The IUPAC name of 5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine (CID 22288393) is 5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine.
What is the SMILES notation for 5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine?
The canonical SMILES for 5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine is Cn1nc(C(F)(F)F)cc1-c1ccc(N)s1.
What is the InChIKey of 5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine?
The InChIKey is YGZGZZMUUJBDOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F3N3S/c1-15-5(6-2-3-8(13)16-6)4-7(14-15)9(10,11)12/h2-4H,13H2,1H3.
What are the key properties of 5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine?
5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine has a molecular weight of 247.25 g/mol, XLogP of 2.75, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-amine is sourced from PubChem (CID 22288393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).