2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide

C11H10N2O2S — CID 117086203

IUPAC2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide
SMILESCOc1ccc(-c2ncc(C(N)=O)s2)cc1
InChIInChI=1S/C11H10N2O2S/c1-15-8-4-2-7(3-5-8)11-13-6-9(16-11)10(12)14/h2-6H,1H3,(H2,12,14)
InChIKeySAHVOSQHIBWQJN-UHFFFAOYSA-N
MW234.28 g/mol
LogP1.92
Rot. Bonds3

About 2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide

2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide (PubChem CID 117086203) has the molecular formula C11H10N2O2S and a molecular weight of 234.28 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide
PubChem CID117086203
Molecular FormulaC11H10N2O2S
Molecular Weight234.28 g/mol
Exact Mass234.05
IUPAC Name2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide
SMILESCOc1ccc(-c2ncc(C(N)=O)s2)cc1
InChIInChI=1S/C11H10N2O2S/c1-15-8-4-2-7(3-5-8)11-13-6-9(16-11)10(12)14/h2-6H,1H3,(H2,12,14)
InChIKeySAHVOSQHIBWQJN-UHFFFAOYSA-N
XLogP1.92
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methoxyphenyl)-N-methyl-2-(3-methylphenyl)-1,3-thiazole-5-carboxamide
CID 60196908
2-(2,4-Dimethoxyphenyl)-N-(7-(hydroxyamino)-7-oxoheptyl)thiazole-5-carboxamide
CID 162679245
5-Thiazolecarboxamide, 2-(4-methoxyphenyl)-4-methyl-
CID 3068075
2-Methyl-2-[4-[[(2-phenyl-1,3-thiazole-5-carbonyl)amino]methyl]phenoxy]propanoic acid
CID 44419009
(E)-N-hydroxy-3-[2-(4-methoxyphenyl)-1,3-thiazol-5-yl]prop-2-enamide
CID 166626112
(E)-N-(2-aminophenyl)-3-[2-(4-methoxyphenyl)-1,3-thiazol-5-yl]prop-2-enamide
CID 166627826
N-[7-(hydroxyamino)-7-oxoheptyl]-2-(2-methoxyphenyl)-1,3-thiazole-5-carboxamide
CID 166629132
(E)-N-hydroxy-3-[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]prop-2-enamide
CID 166629470
N-[7-(hydroxyamino)-7-oxoheptyl]-2-(3-methoxyphenyl)-1,3-thiazole-5-carboxamide
CID 166629491
2-(2,4-dimethoxyphenyl)-N-[5-(hydroxyamino)-5-oxopentyl]-1,3-thiazole-5-carboxamide
CID 166630119
N-[7-(hydroxyamino)-7-oxoheptyl]-2-(4-phenoxyphenyl)-1,3-thiazole-5-carboxamide
CID 166630419
N-[7-(hydroxyamino)-7-oxoheptyl]-2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide
CID 166633824

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide (CID 117086203) is 2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide is COc1ccc(-c2ncc(C(N)=O)s2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide?
The InChIKey is SAHVOSQHIBWQJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2S/c1-15-8-4-2-7(3-5-8)11-13-6-9(16-11)10(12)14/h2-6H,1H3,(H2,12,14).
What are the key properties of 2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide?
2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide has a molecular weight of 234.28 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 117086203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).