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

C11H9ClN2OS — CID 110723358

IUPAC3-chloro-N-methyl-N-(1,3-thiazol-2-yl)benzamide
SMILESCN(C(=O)c1cccc(Cl)c1)c1nccs1
InChIInChI=1S/C11H9ClN2OS/c1-14(11-13-5-6-16-11)10(15)8-3-2-4-9(12)7-8/h2-7H,1H3
InChIKeyYMFOVBGNFMYTSV-UHFFFAOYSA-N
MW252.73 g/mol
LogP3.07
Rot. Bonds2

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

3-chloro-N-methyl-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 110723358) has the molecular formula C11H9ClN2OS and a molecular weight of 252.73 g/mol. Its IUPAC name is 3-chloro-N-methyl-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-chloro-N-methyl-N-(1,3-thiazol-2-yl)benzamide
PubChem CID110723358
Molecular FormulaC11H9ClN2OS
Molecular Weight252.73 g/mol
Exact Mass252.01
IUPAC Name3-chloro-N-methyl-N-(1,3-thiazol-2-yl)benzamide
SMILESCN(C(=O)c1cccc(Cl)c1)c1nccs1
InChIInChI=1S/C11H9ClN2OS/c1-14(11-13-5-6-16-11)10(15)8-3-2-4-9(12)7-8/h2-7H,1H3
InChIKeyYMFOVBGNFMYTSV-UHFFFAOYSA-N
XLogP3.07
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.73
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-methyl-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
CID 1175846
1-(3-chlorophenyl)-N-methyl-N-(1,3-thiazol-2-yl)cyclohexane-1-carboxamide
CID 55642429
6-chloro-N-methyl-N-(1,3-thiazol-2-yl)-1H-indole-2-carboxamide
CID 86768422
2,6-dimethoxy-N-methyl-N-(1,3-thiazol-2-yl)benzamide
CID 110723339
3-fluoro-4-methoxy-N-methyl-N-(1,3-thiazol-2-yl)benzamide
CID 86980050
1-(3-chlorophenyl)-2-(1,3-thiazol-2-ylsulfanyl)propan-1-one
CID 61220658
N-methyl-N-(1,3-thiazol-2-yl)carbamoyl chloride
CID 119090287
4-(dimethylsulfamoyl)-N-methyl-N-(1,3-thiazol-2-yl)benzamide
CID 110723354
2-bromo-N-methyl-N-(1,3-thiazol-2-yl)benzamide
CID 47182345
N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide
CID 55642635
N-[4-(aminomethyl)phenyl]-3-chloro-N-methylbenzamide
CID 28755656
4-chloro-N-methyl-3-[phenyl(prop-2-enyl)sulfamoyl]-N-(1,3-thiazol-2-yl)benzamide
CID 55642713

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-methyl-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3-chloro-N-methyl-N-(1,3-thiazol-2-yl)benzamide (CID 110723358) is 3-chloro-N-methyl-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3-chloro-N-methyl-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3-chloro-N-methyl-N-(1,3-thiazol-2-yl)benzamide is CN(C(=O)c1cccc(Cl)c1)c1nccs1.
What is the InChIKey of 3-chloro-N-methyl-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is YMFOVBGNFMYTSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2OS/c1-14(11-13-5-6-16-11)10(15)8-3-2-4-9(12)7-8/h2-7H,1H3.
What are the key properties of 3-chloro-N-methyl-N-(1,3-thiazol-2-yl)benzamide?
3-chloro-N-methyl-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 252.73 g/mol, XLogP of 3.07, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-methyl-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 110723358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).