2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide

C22H19FN4O2S — CID 25281994

IUPAC2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide
SMILESCOc1cccc(-c2csc(-n3nc(C)cc3NC(=O)Cc3ccc(F)cc3)n2)c1
InChIInChI=1S/C22H19FN4O2S/c1-14-10-20(25-21(28)11-15-6-8-17(23)9-7-15)27(26-14)22-24-19(13-30-22)16-4-3-5-18(12-16)29-2/h3-10,12-13H,11H2,1-2H3,(H,25,28)
InChIKeyOSRUCTHGWNCQDI-UHFFFAOYSA-N
MW422.49 g/mol
LogP4.63
Rot. Bonds6

About 2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide

2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide (PubChem CID 25281994) has the molecular formula C22H19FN4O2S and a molecular weight of 422.49 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide
PubChem CID25281994
Molecular FormulaC22H19FN4O2S
Molecular Weight422.49 g/mol
Exact Mass422.12
IUPAC Name2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide
SMILESCOc1cccc(-c2csc(-n3nc(C)cc3NC(=O)Cc3ccc(F)cc3)n2)c1
InChIInChI=1S/C22H19FN4O2S/c1-14-10-20(25-21(28)11-15-6-8-17(23)9-7-15)27(26-14)22-24-19(13-30-22)16-4-3-5-18(12-16)29-2/h3-10,12-13H,11H2,1-2H3,(H,25,28)
InChIKeyOSRUCTHGWNCQDI-UHFFFAOYSA-N
XLogP4.63
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.49
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide 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

N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2-[[5-(2-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide
CID 4965237
2-(4-Fluorophenyl)-N-{2-[2-(4-methoxyphenyl)-[1,2,4]triazolo[3,2-B][1,3]thiazol-6-YL]ethyl}acetamide
CID 7243428
3-[2-(3,5-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-(4-methyl-1,3-thiazol-2-yl)propanamide
CID 15945553
N-(4-Ethylphenyl)-2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-YL}-4-methyl-1,3-thiazole-5-carboxamide
CID 16015330
N-[2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]-3-(trifluoromethyl)benzamide
CID 25282247
1H-Pyrazol-5-amine, 3-(4-methoxyphenyl)-1-(4-phenyl-2-thiazolyl)-
CID 852600
2-(4-ethoxyphenyl)-N-(2-(2-(2-fluorophenyl)thiazolo[3,2-b][1,2,4]triazol-6-yl)ethyl)acetamide
CID 16028733
1-[2-[4-[4-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]ethyl]-3-methyl-4-(trifluoromethyl)-7H-pyrazolo[5,4-b]pyridin-6-one
CID 135508281
N-[2-(1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]-4-methoxybenzamide
CID 2352185
N-(3-Acetylphenyl)-2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-YL}-4-methyl-1,3-thiazole-5-carboxamide
CID 16015332
2-(4-Ethoxyphenyl)-N-{2-[2-(4-fluorophenyl)-6-methyl-[1,2,4]triazolo[3,2-B][1,3]thiazol-5-YL]ethyl}acetamide
CID 16032689
2-(4-Fluorophenyl)-N-{2-[2-(4-methoxyphenyl)-6-methyl-[1,2,4]triazolo[3,2-B][1,3]thiazol-5-YL]ethyl}acetamide
CID 16032789

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide?
The IUPAC name of 2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide (CID 25281994) is 2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide is COc1cccc(-c2csc(-n3nc(C)cc3NC(=O)Cc3ccc(F)cc3)n2)c1.
What is the InChIKey of 2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide?
The InChIKey is OSRUCTHGWNCQDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN4O2S/c1-14-10-20(25-21(28)11-15-6-8-17(23)9-7-15)27(26-14)22-24-19(13-30-22)16-4-3-5-18(12-16)29-2/h3-10,12-13H,11H2,1-2H3,(H,25,28).
What are the key properties of 2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide?
2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide has a molecular weight of 422.49 g/mol, XLogP of 4.63, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-[2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]acetamide is sourced from PubChem (CID 25281994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).