3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide

C13H14N2O2S — CID 17425685

IUPAC3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCOc1cc(C(=O)Nc2nc(C)cs2)ccc1C
InChIInChI=1S/C13H14N2O2S/c1-8-4-5-10(6-11(8)17-3)12(16)15-13-14-9(2)7-18-13/h4-7H,1-3H3,(H,14,15,16)
InChIKeyQJVKWYSRAKJNHK-UHFFFAOYSA-N
MW262.33 g/mol
LogP3.02
Rot. Bonds3

About 3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide

3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 17425685) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is 3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID17425685
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC Name3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCOc1cc(C(=O)Nc2nc(C)cs2)ccc1C
InChIInChI=1S/C13H14N2O2S/c1-8-4-5-10(6-11(8)17-3)12(16)15-13-14-9(2)7-18-13/h4-7H,1-3H3,(H,14,15,16)
InChIKeyQJVKWYSRAKJNHK-UHFFFAOYSA-N
XLogP3.02
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 17361583
3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)-4-propan-2-yloxybenzamide
CID 46674292
3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 110764330
3-methoxy-4-methyl-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]benzamide
CID 42009828
ethyl 2-[(3-methoxy-4-methylbenzoyl)amino]-1,3-thiazole-4-carboxylate
CID 51229930
3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)-4-phenylmethoxybenzamide
CID 2463682
3-methoxy-4-methyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)benzamide
CID 18229856
4-bromo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 683754
4-N-(4-methyl-1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
CID 47106736
4-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 885062
N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]-3-methoxy-4-methylbenzamide
CID 55413859
3,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 1246749

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide (CID 17425685) is 3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide is COc1cc(C(=O)Nc2nc(C)cs2)ccc1C.
What is the InChIKey of 3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is QJVKWYSRAKJNHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-8-4-5-10(6-11(8)17-3)12(16)15-13-14-9(2)7-18-13/h4-7H,1-3H3,(H,14,15,16).
What are the key properties of 3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 262.33 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 17425685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).