5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide

C19H15FN4OS2 — CID 55581400

IUPAC5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide
SMILESCCc1c(C(=O)Nc2nc(-c3cccs3)cs2)cnn1-c1ccc(F)cc1
InChIInChI=1S/C19H15FN4OS2/c1-2-16-14(10-21-24(16)13-7-5-12(20)6-8-13)18(25)23-19-22-15(11-27-19)17-4-3-9-26-17/h3-11H,2H2,1H3,(H,22,23,25)
InChIKeySKDGFGOKCPOFLF-UHFFFAOYSA-N
MW398.49 g/mol
LogP5.01
Rot. Bonds5

About 5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide

5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide (PubChem CID 55581400) has the molecular formula C19H15FN4OS2 and a molecular weight of 398.49 g/mol. Its IUPAC name is 5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide
PubChem CID55581400
Molecular FormulaC19H15FN4OS2
Molecular Weight398.49 g/mol
Exact Mass398.07
IUPAC Name5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide
SMILESCCc1c(C(=O)Nc2nc(-c3cccs3)cs2)cnn1-c1ccc(F)cc1
InChIInChI=1S/C19H15FN4OS2/c1-2-16-14(10-21-24(16)13-7-5-12(20)6-8-13)18(25)23-19-22-15(11-27-19)17-4-3-9-26-17/h3-11H,2H2,1H3,(H,22,23,25)
InChIKeySKDGFGOKCPOFLF-UHFFFAOYSA-N
XLogP5.01
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.49
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-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

5-ethyl-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-1-phenylpyrazole-4-carboxamide
CID 55722893
5-ethyl-N-(3-ethylphenyl)-1-(4-fluorophenyl)pyrazole-4-carboxamide
CID 31887301
4-(4-fluorophenyl)-4-oxo-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)butanamide
CID 108742129
5-ethyl-N'-(2-fluorobenzoyl)-1-(4-fluorophenyl)pyrazole-4-carbohydrazide
CID 31891063
5-ethyl-1-(4-fluorophenyl)-N'-(2-hydroxybenzoyl)pyrazole-4-carbohydrazide
CID 31978367
7-fluoro-2-methyl-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)quinoline-4-carboxamide
CID 46686353
1-[[5-ethyl-1-(4-fluorophenyl)pyrazole-4-carbonyl]amino]-3-methylurea
CID 86835872
5-ethyl-N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-1-pyridin-2-ylpyrazole-4-carboxamide
CID 112821652
N-[(2S)-1-aminopropan-2-yl]-5-ethyl-1-(4-fluorophenyl)pyrazole-4-carboxamide;hydrochloride
CID 120506558
methyl (2S)-2-[[5-ethyl-1-(4-fluorophenyl)pyrazole-4-carbonyl]amino]propanoate
CID 87040238
3-[[5-ethyl-1-(4-fluorophenyl)pyrazole-4-carbonyl]amino]propanoic acid
CID 119176883
N-(3,4-dimethoxyphenyl)-5-ethyl-1-(4-fluorophenyl)pyrazole-4-carboxamide
CID 31900906

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide?
The IUPAC name of 5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide (CID 55581400) is 5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide.
What is the SMILES notation for 5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide?
The canonical SMILES for 5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide is CCc1c(C(=O)Nc2nc(-c3cccs3)cs2)cnn1-c1ccc(F)cc1.
What is the InChIKey of 5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide?
The InChIKey is SKDGFGOKCPOFLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4OS2/c1-2-16-14(10-21-24(16)13-7-5-12(20)6-8-13)18(25)23-19-22-15(11-27-19)17-4-3-9-26-17/h3-11H,2H2,1H3,(H,22,23,25).
What are the key properties of 5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide?
5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide has a molecular weight of 398.49 g/mol, XLogP of 5.01, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1-(4-fluorophenyl)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)pyrazole-4-carboxamide is sourced from PubChem (CID 55581400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).