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

C12H12N2OS — CID 953286

IUPAC2,4-dimethyl-N-(1,3-thiazol-2-yl)benzamide
SMILESCc1ccc(C(=O)Nc2nccs2)c(C)c1
InChIInChI=1S/C12H12N2OS/c1-8-3-4-10(9(2)7-8)11(15)14-12-13-5-6-16-12/h3-7H,1-2H3,(H,13,14,15)
InChIKeyNMVHVLNGMVIXCQ-UHFFFAOYSA-N
MW232.31 g/mol
LogP3.01
Rot. Bonds2

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

2,4-dimethyl-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 953286) has the molecular formula C12H12N2OS and a molecular weight of 232.31 g/mol. Its IUPAC name is 2,4-dimethyl-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2,4-dimethyl-N-(1,3-thiazol-2-yl)benzamide
PubChem CID953286
Molecular FormulaC12H12N2OS
Molecular Weight232.31 g/mol
Exact Mass232.07
IUPAC Name2,4-dimethyl-N-(1,3-thiazol-2-yl)benzamide
SMILESCc1ccc(C(=O)Nc2nccs2)c(C)c1
InChIInChI=1S/C12H12N2OS/c1-8-3-4-10(9(2)7-8)11(15)14-12-13-5-6-16-12/h3-7H,1-2H3,(H,13,14,15)
InChIKeyNMVHVLNGMVIXCQ-UHFFFAOYSA-N
XLogP3.01
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.31
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-2-methyl-N-(1,3-thiazol-2-yl)benzamide
CID 65307966
7-methyl-N-(1,3-thiazol-2-yl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 110763742
4-(4-methylphenoxy)-N-(1,3-thiazol-2-yl)benzamide
CID 16651068
3-amino-4-methyl-N-(1,3-thiazol-2-yl)benzamide
CID 16771043
[2-methyl-4-(1,3-thiazol-2-ylcarbamoyl)phenyl]carbamic acid
CID 87845278
N-(4-tert-butyl-1,3-thiazol-2-yl)-2,4-dimethylbenzamide
CID 3372647
4-[3-(2,4-dimethylphenoxy)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide
CID 55669637
2,4-dimethyl-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]benzamide
CID 100644344
5-bromo-2,3,4-trimethyl-N-(1,3-thiazol-2-yl)benzamide
CID 882261
2,4-dimethyl-N-[4-[1-(methylamino)ethyl]-1,3-thiazol-2-yl]benzamide
CID 64555679
3,5-dimethyl-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 58458875
1,3-dimethyl-2,4-dioxo-N-(1,3-thiazol-2-yl)pyrimidine-5-carboxamide
CID 84560983

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2,4-dimethyl-N-(1,3-thiazol-2-yl)benzamide (CID 953286) is 2,4-dimethyl-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2,4-dimethyl-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2,4-dimethyl-N-(1,3-thiazol-2-yl)benzamide is Cc1ccc(C(=O)Nc2nccs2)c(C)c1.
What is the InChIKey of 2,4-dimethyl-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is NMVHVLNGMVIXCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2OS/c1-8-3-4-10(9(2)7-8)11(15)14-12-13-5-6-16-12/h3-7H,1-2H3,(H,13,14,15).
What are the key properties of 2,4-dimethyl-N-(1,3-thiazol-2-yl)benzamide?
2,4-dimethyl-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 232.31 g/mol, XLogP of 3.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 953286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).