N-(2-ethylphenyl)-1,3-thiazole-4-carboxamide

C12H12N2OS — CID 62046507

IUPACN-(2-ethylphenyl)-1,3-thiazole-4-carboxamide
SMILESCCc1ccccc1NC(=O)c1cscn1
InChIInChI=1S/C12H12N2OS/c1-2-9-5-3-4-6-10(9)14-12(15)11-7-16-8-13-11/h3-8H,2H2,1H3,(H,14,15)
InChIKeyOLZYCDWZHFPCHM-UHFFFAOYSA-N
MW232.31 g/mol
LogP2.96
Rot. Bonds3

About N-(2-ethylphenyl)-1,3-thiazole-4-carboxamide

N-(2-ethylphenyl)-1,3-thiazole-4-carboxamide (PubChem CID 62046507) has the molecular formula C12H12N2OS and a molecular weight of 232.31 g/mol. Its IUPAC name is N-(2-ethylphenyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-1,3-thiazole-4-carboxamide
PubChem CID62046507
Molecular FormulaC12H12N2OS
Molecular Weight232.31 g/mol
Exact Mass232.07
IUPAC NameN-(2-ethylphenyl)-1,3-thiazole-4-carboxamide
SMILESCCc1ccccc1NC(=O)c1cscn1
InChIInChI=1S/C12H12N2OS/c1-2-9-5-3-4-6-10(9)14-12(15)11-7-16-8-13-11/h3-8H,2H2,1H3,(H,14,15)
InChIKeyOLZYCDWZHFPCHM-UHFFFAOYSA-N
XLogP2.96
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.31
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[2-(methylamino)-2-oxoethyl]phenyl]-1,3-thiazole-4-carboxamide
CID 62045995
N-(2-chlorophenyl)-1,3-thiazole-4-carboxamide
CID 62046847
N-(2-cyanophenyl)-1,3-thiazole-4-carboxamide
CID 63024235
2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092181
5-ethyl-2-(1,3-thiazole-4-carbonylamino)benzoic acid
CID 110462206
N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]-1,3-thiazole-4-carboxamide
CID 62045168
1-N,2-N-bis(2-ethylphenyl)benzene-1,2-dicarboxamide
CID 4151337
6-chloro-N-(2-ethylphenyl)pyridazine-3-carboxamide
CID 60859186
N-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide
CID 62046501
N-(2-ethylphenyl)-1-methyltriazole-4-carboxamide
CID 45497225
2-[(2-ethylphenyl)carbamoyl]-1,3-thiazole-4-carboxylic acid
CID 116696638
2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090820

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(2-ethylphenyl)-1,3-thiazole-4-carboxamide (CID 62046507) is N-(2-ethylphenyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(2-ethylphenyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(2-ethylphenyl)-1,3-thiazole-4-carboxamide is CCc1ccccc1NC(=O)c1cscn1.
What is the InChIKey of N-(2-ethylphenyl)-1,3-thiazole-4-carboxamide?
The InChIKey is OLZYCDWZHFPCHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2OS/c1-2-9-5-3-4-6-10(9)14-12(15)11-7-16-8-13-11/h3-8H,2H2,1H3,(H,14,15).
What are the key properties of N-(2-ethylphenyl)-1,3-thiazole-4-carboxamide?
N-(2-ethylphenyl)-1,3-thiazole-4-carboxamide has a molecular weight of 232.31 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 62046507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).