5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide

C16H14N2OS2 — CID 9110040

IUPAC5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide
SMILESCc1csc(N(C(=O)c2ccc(C)s2)c2ccccc2)n1
InChIInChI=1S/C16H14N2OS2/c1-11-10-20-16(17-11)18(13-6-4-3-5-7-13)15(19)14-9-8-12(2)21-14/h3-10H,1-2H3
InChIKeyJJECQNJKKZACAM-UHFFFAOYSA-N
MW314.44 g/mol
LogP4.80
Rot. Bonds3

About 5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide

5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide (PubChem CID 9110040) has the molecular formula C16H14N2OS2 and a molecular weight of 314.44 g/mol. Its IUPAC name is 5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide
PubChem CID9110040
Molecular FormulaC16H14N2OS2
Molecular Weight314.44 g/mol
Exact Mass314.05
IUPAC Name5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide
SMILESCc1csc(N(C(=O)c2ccc(C)s2)c2ccccc2)n1
InChIInChI=1S/C16H14N2OS2/c1-11-10-20-16(17-11)18(13-6-4-3-5-7-13)15(19)14-9-8-12(2)21-14/h3-10H,1-2H3
InChIKeyJJECQNJKKZACAM-UHFFFAOYSA-N
XLogP4.80
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.44
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylpyrimidine-4-carboxamide
CID 75415495
N-(4-methyl-1,3-thiazol-2-yl)-N-phenylprop-2-enamide
CID 43616649
N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-2H-chromene-3-carboxamide
CID 43032454
2-chloro-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylpyridine-3-carboxamide
CID 52895835
2,5-dimethoxy-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylbenzamide
CID 43024651
N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-4-(propan-2-ylsulfamoyl)benzamide
CID 16593120
3-chloro-2-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylpropanamide
CID 62727733
N-(4-methyl-1,3-thiazol-2-yl)-N-phenylhexanamide
CID 78778253
2-chloro-6-(dimethylamino)-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylpyridine-4-carboxamide
CID 99807622
N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide
CID 112819481
2,2-dichloro-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylcyclopropane-1-carboxamide
CID 78778238
(2S)-2-benzylsulfanyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylpropanamide
CID 51958198

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide?
The IUPAC name of 5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide (CID 9110040) is 5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide.
What is the SMILES notation for 5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide?
The canonical SMILES for 5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide is Cc1csc(N(C(=O)c2ccc(C)s2)c2ccccc2)n1.
What is the InChIKey of 5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide?
The InChIKey is JJECQNJKKZACAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2OS2/c1-11-10-20-16(17-11)18(13-6-4-3-5-7-13)15(19)14-9-8-12(2)21-14/h3-10H,1-2H3.
What are the key properties of 5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide?
5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide has a molecular weight of 314.44 g/mol, XLogP of 4.80, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylthiophene-2-carboxamide is sourced from PubChem (CID 9110040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).