N-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide

C12H12N2OS — CID 110692180

IUPACN-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide
SMILESCc1cccc(NC(=O)c2ccns2)c1C
InChIInChI=1S/C12H12N2OS/c1-8-4-3-5-10(9(8)2)14-12(15)11-6-7-13-16-11/h3-7H,1-2H3,(H,14,15)
InChIKeyZCOPFUIEMZCGKF-UHFFFAOYSA-N
MW232.31 g/mol
LogP3.01
Rot. Bonds2

About N-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide

N-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide (PubChem CID 110692180) has the molecular formula C12H12N2OS and a molecular weight of 232.31 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide
PubChem CID110692180
Molecular FormulaC12H12N2OS
Molecular Weight232.31 g/mol
Exact Mass232.07
IUPAC NameN-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide
SMILESCc1cccc(NC(=O)c2ccns2)c1C
InChIInChI=1S/C12H12N2OS/c1-8-4-3-5-10(9(8)2)14-12(15)11-6-7-13-16-11/h3-7H,1-2H3,(H,14,15)
InChIKeyZCOPFUIEMZCGKF-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

N-(2,3-dimethylphenyl)-5-methylthiophene-2-carboxamide
CID 7733041
ethyl 2-(1,2-thiazole-5-carbonylamino)benzoate
CID 110692261
3-N-(2,3-dimethylphenyl)-1-N-(2-methylphenyl)benzene-1,3-dicarboxamide
CID 109056848
N-[2-methyl-5-[(2-methylsulfanyl-3-pyridinyl)carbamoyl]phenyl]-1,2-thiazole-5-carboxamide
CID 172657474
N-(2-ethoxyphenyl)-1,2-thiazole-5-carboxamide
CID 110692203
N-(2,3-dimethylphenyl)-3-methylthiophene-2-carboxamide
CID 7947060
N-(2,3-dimethylphenyl)pyrazine-2-carboxamide
CID 694797
2-bromo-N-(2,3-dimethylphenyl)-3-methylbenzamide
CID 103852657
N-(2,3-dimethylphenyl)-4-fluorobenzamide
CID 795282
N-(2,3-dimethylphenyl)-N'-pyrimidin-2-yloxamide
CID 44996588
3-chloro-N-(2,3-dimethylphenyl)pyridine-4-carboxamide
CID 66462249
4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
CID 62156095

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide?
The IUPAC name of N-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide (CID 110692180) is N-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide is Cc1cccc(NC(=O)c2ccns2)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide?
The InChIKey is ZCOPFUIEMZCGKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2OS/c1-8-4-3-5-10(9(8)2)14-12(15)11-6-7-13-16-11/h3-7H,1-2H3,(H,14,15).
What are the key properties of N-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide?
N-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide 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 N-(2,3-dimethylphenyl)-1,2-thiazole-5-carboxamide is sourced from PubChem (CID 110692180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).