N-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide

C12H13N3O2S — CID 82342440

IUPACN-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2nc(C)c(N)s2)cc1
InChIInChI=1S/C12H13N3O2S/c1-7-10(13)18-12(14-7)15-11(16)8-3-5-9(17-2)6-4-8/h3-6H,13H2,1-2H3,(H,14,15,16)
InChIKeyUSOYWSNOYBZWQX-UHFFFAOYSA-N
MW263.32 g/mol
LogP2.29
Rot. Bonds3

About N-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide

N-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide (PubChem CID 82342440) has the molecular formula C12H13N3O2S and a molecular weight of 263.32 g/mol. Its IUPAC name is N-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide.

Molecular Properties

Compound NameN-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide
PubChem CID82342440
Molecular FormulaC12H13N3O2S
Molecular Weight263.32 g/mol
Exact Mass263.07
IUPAC NameN-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2nc(C)c(N)s2)cc1
InChIInChI=1S/C12H13N3O2S/c1-7-10(13)18-12(14-7)15-11(16)8-3-5-9(17-2)6-4-8/h3-6H,13H2,1-2H3,(H,14,15,16)
InChIKeyUSOYWSNOYBZWQX-UHFFFAOYSA-N
XLogP2.29
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-amino-4-methyl-1,3-thiazol-2-yl)pyridine-4-carboxamide
CID 82342465
N-(5-amino-4-propan-2-yl-1,3-thiazol-2-yl)-4-methoxybenzamide
CID 82342528
N-(5-amino-4-methyl-1,3-thiazol-2-yl)-3,4-dimethylbenzamide
CID 82342443
4-methoxy-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 31154800
N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-4-methoxybenzamide
CID 7172907
4-fluoro-N-[5-[(4-methoxyphenyl)methyl]-4-methyl-1,3-thiazol-2-yl]benzamide
CID 43836518
4-methoxy-N-(6-methoxy-1,3-benzothiazol-2-yl)benzamide
CID 584682
methyl 4-methyl-2-[[4-(2-methylpropoxy)benzoyl]amino]-1,3-thiazole-5-carboxylate
CID 23763670
4-tert-butyl-N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]benzamide
CID 1315978
N-(4,5-dimethyl-1,3-thiazol-2-yl)-4-(methylamino)benzamide
CID 55046054
4-(2,5-dimethylpyrrol-1-yl)-N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]benzamide
CID 7916056
methyl 4-[(4,7-dimethyl-1,3-benzothiazol-2-yl)carbamoyl]benzoate
CID 7192912

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide?
The IUPAC name of N-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide (CID 82342440) is N-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide.
What is the SMILES notation for N-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide?
The canonical SMILES for N-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide is COc1ccc(C(=O)Nc2nc(C)c(N)s2)cc1.
What is the InChIKey of N-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide?
The InChIKey is USOYWSNOYBZWQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2S/c1-7-10(13)18-12(14-7)15-11(16)8-3-5-9(17-2)6-4-8/h3-6H,13H2,1-2H3,(H,14,15,16).
What are the key properties of N-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide?
N-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide has a molecular weight of 263.32 g/mol, XLogP of 2.29, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-4-methyl-1,3-thiazol-2-yl)-4-methoxybenzamide is sourced from PubChem (CID 82342440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).