N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide

C11H8Cl2N2OS — CID 110696253

IUPACN-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide
SMILESCc1csc(C(=O)Nc2c(Cl)cccc2Cl)n1
InChIInChI=1S/C11H8Cl2N2OS/c1-6-5-17-11(14-6)10(16)15-9-7(12)3-2-4-8(9)13/h2-5H,1H3,(H,15,16)
InChIKeyJOWLCPSWPFLKNF-UHFFFAOYSA-N
MW287.17 g/mol
LogP4.01
Rot. Bonds2

About N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide

N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide (PubChem CID 110696253) has the molecular formula C11H8Cl2N2OS and a molecular weight of 287.17 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide
PubChem CID110696253
Molecular FormulaC11H8Cl2N2OS
Molecular Weight287.17 g/mol
Exact Mass285.97
IUPAC NameN-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide
SMILESCc1csc(C(=O)Nc2c(Cl)cccc2Cl)n1
InChIInChI=1S/C11H8Cl2N2OS/c1-6-5-17-11(14-6)10(16)15-9-7(12)3-2-4-8(9)13/h2-5H,1H3,(H,15,16)
InChIKeyJOWLCPSWPFLKNF-UHFFFAOYSA-N
XLogP4.01
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.17
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-dimethylphenyl)-4-methyl-1,3-thiazole-2-carboxamide
CID 110696181
4-methyl-N-(4-methyl-1,3-thiazol-2-yl)-1,3-thiazole-2-carboxamide
CID 110696245
N-(4-chloro-2-methylphenyl)-4-methyl-1,3-thiazole-2-carboxamide
CID 110696195
4-methyl-N-pyridin-2-yl-1,3-thiazole-2-carboxamide
CID 110696243
N-(2-bromophenyl)-4-methyl-1,3-thiazole-2-carboxamide
CID 110696235
N-(2-ethylphenyl)-4-methyl-1,3-thiazole-2-carboxamide
CID 110696183
methyl 4-chloro-3-[(4-methyl-1,3-thiazole-2-carbonyl)amino]benzoate
CID 110696223
N-(3-methoxyphenyl)-4-methyl-1,3-thiazole-2-carboxamide
CID 110696202
2-N,6-N-bis(4-methyl-1,3-thiazol-2-yl)pyridine-2,6-dicarboxamide
CID 19684989
N-benzyl-4-methyl-1,3-thiazole-2-carboxamide
CID 10399050
ethyl 2-[(4-methyl-1,3-thiazole-2-carbonyl)amino]benzoate
CID 110696258
2-chloro-N-[3-[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]phenyl]benzamide
CID 9212252

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide?
The IUPAC name of N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide (CID 110696253) is N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide is Cc1csc(C(=O)Nc2c(Cl)cccc2Cl)n1.
What is the InChIKey of N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide?
The InChIKey is JOWLCPSWPFLKNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl2N2OS/c1-6-5-17-11(14-6)10(16)15-9-7(12)3-2-4-8(9)13/h2-5H,1H3,(H,15,16).
What are the key properties of N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide?
N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide has a molecular weight of 287.17 g/mol, XLogP of 4.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-4-methyl-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 110696253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).