3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide

C15H9F5N4OS — CID 56847748

IUPAC3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide
SMILESCn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2c(F)cncc2F)s1
InChIInChI=1S/C15H9F5N4OS/c1-24-9(4-11(23-24)15(18,19)20)10-2-3-12(26-10)22-14(25)13-7(16)5-21-6-8(13)17/h2-6H,1H3,(H,22,25)
InChIKeyKOECEZLEGQWXJZ-UHFFFAOYSA-N
MW388.32 g/mol
LogP4.09
Rot. Bonds3

About 3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide

3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide (PubChem CID 56847748) has the molecular formula C15H9F5N4OS and a molecular weight of 388.32 g/mol. Its IUPAC name is 3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide.

Molecular Properties

Compound Name3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide
PubChem CID56847748
Molecular FormulaC15H9F5N4OS
Molecular Weight388.32 g/mol
Exact Mass388.04
IUPAC Name3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide
SMILESCn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2c(F)cncc2F)s1
InChIInChI=1S/C15H9F5N4OS/c1-24-9(4-11(23-24)15(18,19)20)10-2-3-12(26-10)22-14(25)13-7(16)5-21-6-8(13)17/h2-6H,1H3,(H,22,25)
InChIKeyKOECEZLEGQWXJZ-UHFFFAOYSA-N
XLogP4.09
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.32
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

3-(5-ME-2-Thienyl)-N'-(1-(4-pyridinyl)ethylidene)-1H-pyrazole-5-carbohydrazide
CID 5393006
N-[4-[3-(Trifluoromethyl)-5-(methylthio)-1H-pyrazole-1-yl]phenyl]-3-fluoropyridine-4-carboxamide
CID 10524777
N'-{(E)-[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}pyridine-4-carbohydrazide
CID 6900173
5-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(4-pyridin-3-ylphenyl)thiophene-2-carboxamide
CID 164617763
2-fluoro-N-[5-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophen-2-yl]benzamide
CID 56847745
2,6-difluoro-N-[5-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophen-2-yl]benzamide
CID 56847746
3-fluoro-N-[5-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]-1,3-thiazol-2-yl]pyridine-4-carboxamide
CID 56848138
(3,5-difluoro(4-pyridyl))-N-{5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl](1,3-thiazol-2-yl)}carboxamide
CID 56848139
N-(3,5-difluoro-4-pyridinyl)-5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide
CID 68062356
5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-4-pyridinyl)thiophene-2-carboxamide
CID 68062358
N-(3,5-difluoro-4-pyridinyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide
CID 68062363
N-(3-fluoro-4-pyridinyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide
CID 68062365

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide?
The IUPAC name of 3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide (CID 56847748) is 3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide.
What is the SMILES notation for 3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide?
The canonical SMILES for 3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide is Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2c(F)cncc2F)s1.
What is the InChIKey of 3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide?
The InChIKey is KOECEZLEGQWXJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9F5N4OS/c1-24-9(4-11(23-24)15(18,19)20)10-2-3-12(26-10)22-14(25)13-7(16)5-21-6-8(13)17/h2-6H,1H3,(H,22,25).
What are the key properties of 3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide?
3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide has a molecular weight of 388.32 g/mol, XLogP of 4.09, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-N-[5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]thiophen-2-yl]pyridine-4-carboxamide is sourced from PubChem (CID 56847748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).