N-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide

C14H10FN3O2S — CID 69178255

IUPACN-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide
SMILESCc1nc(-c2ccc(F)cc2)c(NC(=O)c2cscn2)o1
InChIInChI=1S/C14H10FN3O2S/c1-8-17-12(9-2-4-10(15)5-3-9)14(20-8)18-13(19)11-6-21-7-16-11/h2-7H,1H3,(H,18,19)
InChIKeyFUEXOQIHXCTJBE-UHFFFAOYSA-N
MW303.32 g/mol
LogP3.50
Rot. Bonds3

About N-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide

N-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide (PubChem CID 69178255) has the molecular formula C14H10FN3O2S and a molecular weight of 303.32 g/mol. Its IUPAC name is N-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide
PubChem CID69178255
Molecular FormulaC14H10FN3O2S
Molecular Weight303.32 g/mol
Exact Mass303.05
IUPAC NameN-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide
SMILESCc1nc(-c2ccc(F)cc2)c(NC(=O)c2cscn2)o1
InChIInChI=1S/C14H10FN3O2S/c1-8-17-12(9-2-4-10(15)5-3-9)14(20-8)18-13(19)11-6-21-7-16-11/h2-7H,1H3,(H,18,19)
InChIKeyFUEXOQIHXCTJBE-UHFFFAOYSA-N
XLogP3.50
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.32
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-fluoro-2-pyridinyl)-1,3-thiazole-4-carboxamide
CID 63235854
N-(2-bromo-5-fluorophenyl)-1,3-thiazole-4-carboxamide
CID 75425983
N-(2,6-dimethylphenyl)-1,3-thiazole-4-carboxamide
CID 62045312
ethyl 4-(4-fluorophenyl)-5-methyl-2-(1,3-thiazole-4-carbonylamino)thiophene-3-carboxylate
CID 84560402
methyl 4-fluoro-2-(1,3-thiazole-4-carbonylamino)benzoate
CID 63047498
N-[1-(4-fluorophenyl)propan-2-yl]-1,3-thiazole-4-carboxamide
CID 63049098
N-(2,6-difluoro-3-pyridinyl)-1,3-thiazole-4-carboxamide
CID 103097885
N-[4-fluoro-2-[(E)-N'-hydroxycarbamimidoyl]phenyl]-1,3-thiazole-4-carboxamide
CID 82685689
4-(4-fluorophenyl)-2-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-oxazole-5-carboxamide
CID 176859167
N-[4-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]phenyl]-1,3-thiazole-4-carboxamide
CID 90149485
N-(2,5-difluoro-4-methylphenyl)-1,3-thiazole-4-carboxamide
CID 103586232
N-(2-chloro-6-methylphenyl)-1,3-thiazole-4-carboxamide
CID 66255718

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide?
The IUPAC name of N-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide (CID 69178255) is N-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide is Cc1nc(-c2ccc(F)cc2)c(NC(=O)c2cscn2)o1.
What is the InChIKey of N-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide?
The InChIKey is FUEXOQIHXCTJBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN3O2S/c1-8-17-12(9-2-4-10(15)5-3-9)14(20-8)18-13(19)11-6-21-7-16-11/h2-7H,1H3,(H,18,19).
What are the key properties of N-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide?
N-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide has a molecular weight of 303.32 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-fluorophenyl)-2-methyl-1,3-oxazol-5-yl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 69178255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).