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

C15H13N3OS — CID 2085562

IUPAC2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide
SMILESCc1csc(NC(=O)c2cc(C)nc3ccccc23)n1
InChIInChI=1S/C15H13N3OS/c1-9-7-12(11-5-3-4-6-13(11)16-9)14(19)18-15-17-10(2)8-20-15/h3-8H,1-2H3,(H,17,18,19)
InChIKeyNIQXBEYZVQMQNK-UHFFFAOYSA-N
MW283.36 g/mol
LogP3.56
Rot. Bonds2

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

2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide (PubChem CID 2085562) has the molecular formula C15H13N3OS and a molecular weight of 283.36 g/mol. Its IUPAC name is 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide
PubChem CID2085562
Molecular FormulaC15H13N3OS
Molecular Weight283.36 g/mol
Exact Mass283.08
IUPAC Name2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide
SMILESCc1csc(NC(=O)c2cc(C)nc3ccccc23)n1
InChIInChI=1S/C15H13N3OS/c1-9-7-12(11-5-3-4-6-13(11)16-9)14(19)18-15-17-10(2)8-20-15/h3-8H,1-2H3,(H,17,18,19)
InChIKeyNIQXBEYZVQMQNK-UHFFFAOYSA-N
XLogP3.56
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.36
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(2,6-difluorophenyl)-1,3-thiazol-2-yl]-2-methylquinoline-4-carboxamide
CID 39804997
2-methyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)quinoline-4-carboxamide
CID 18291417
2-(2,4-dimethylphenyl)-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide
CID 3707825
2-methyl-N-[4-(phenoxymethyl)-1,3-thiazol-2-yl]quinoline-4-carboxamide
CID 167925938
N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-methylquinoline-4-carboxamide
CID 2102481
2-[(4-methyl-1,3-thiazol-2-yl)amino]quinoline-4-carboxylic acid
CID 43332285
2-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 884818
N-(2-chlorophenyl)-2-methylquinoline-4-carboxamide
CID 856039
N-(6-acetamido-1,3-benzothiazol-2-yl)-2-methylquinoline-4-carboxamide
CID 51336725
N-(4,5-dihydro-1,3-thiazol-2-yl)-2-methylquinoline-4-carboxamide
CID 2117314
N-(2-benzamidoethyl)-2-methylquinoline-4-carboxamide
CID 38202874
2-(dimethylamino)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 110463533

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide?
The IUPAC name of 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide (CID 2085562) is 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide.
What is the SMILES notation for 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide?
The canonical SMILES for 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide is Cc1csc(NC(=O)c2cc(C)nc3ccccc23)n1.
What is the InChIKey of 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide?
The InChIKey is NIQXBEYZVQMQNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3OS/c1-9-7-12(11-5-3-4-6-13(11)16-9)14(19)18-15-17-10(2)8-20-15/h3-8H,1-2H3,(H,17,18,19).
What are the key properties of 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide?
2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide has a molecular weight of 283.36 g/mol, XLogP of 3.56, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(4-methyl-1,3-thiazol-2-yl)quinoline-4-carboxamide is sourced from PubChem (CID 2085562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).