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

C15H13N3O2S — CID 35801722

IUPAC6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)quinoline-2-carboxamide
SMILESCOc1ccc2nc(C(=O)Nc3nc(C)cs3)ccc2c1
InChIInChI=1S/C15H13N3O2S/c1-9-8-21-15(16-9)18-14(19)13-5-3-10-7-11(20-2)4-6-12(10)17-13/h3-8H,1-2H3,(H,16,18,19)
InChIKeyWWMLVNKKMVRIMC-UHFFFAOYSA-N
MW299.36 g/mol
LogP3.26
Rot. Bonds3

About 6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)quinoline-2-carboxamide

6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)quinoline-2-carboxamide (PubChem CID 35801722) has the molecular formula C15H13N3O2S and a molecular weight of 299.36 g/mol. Its IUPAC name is 6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)quinoline-2-carboxamide.

Molecular Properties

Compound Name6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)quinoline-2-carboxamide
PubChem CID35801722
Molecular FormulaC15H13N3O2S
Molecular Weight299.36 g/mol
Exact Mass299.07
IUPAC Name6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)quinoline-2-carboxamide
SMILESCOc1ccc2nc(C(=O)Nc3nc(C)cs3)ccc2c1
InChIInChI=1S/C15H13N3O2S/c1-9-8-21-15(16-9)18-14(19)13-5-3-10-7-11(20-2)4-6-12(10)17-13/h3-8H,1-2H3,(H,16,18,19)
InChIKeyWWMLVNKKMVRIMC-UHFFFAOYSA-N
XLogP3.26
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.36
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-6-methoxyquinoline-2-carboxamide
CID 35804340
6-methoxy-N-[4-[4-[methyl(methylsulfonyl)amino]phenyl]-1,3-thiazol-2-yl]quinoline-2-carboxamide
CID 24586544
6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)-2-oxochromene-3-carboxamide
CID 4913043
2-N,6-N-bis(4-methyl-1,3-thiazol-2-yl)pyridine-2,6-dicarboxamide
CID 19684989
N-(4-ethoxyphenyl)-6-methoxyquinoline-2-carboxamide
CID 33314007
N-(3-acetylphenyl)-6-methoxyquinoline-2-carboxamide
CID 18131971
N-(2,4-difluorophenyl)-6-methoxyquinoline-2-carboxamide
CID 33314527
N-(5-chloro-2,4-dimethoxyphenyl)-6-methoxyquinoline-2-carboxamide
CID 33316078
N-(5-chloro-2-methoxyphenyl)-6-methoxyquinoline-2-carboxamide
CID 33314112
4-methoxy-2-[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]benzoic acid
CID 115412042
N-[4-(cyclopropanecarbonylamino)phenyl]-6-methoxyquinoline-2-carboxamide
CID 24601678
3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 17425685

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)quinoline-2-carboxamide?
The IUPAC name of 6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)quinoline-2-carboxamide (CID 35801722) is 6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)quinoline-2-carboxamide.
What is the SMILES notation for 6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)quinoline-2-carboxamide?
The canonical SMILES for 6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)quinoline-2-carboxamide is COc1ccc2nc(C(=O)Nc3nc(C)cs3)ccc2c1.
What is the InChIKey of 6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)quinoline-2-carboxamide?
The InChIKey is WWMLVNKKMVRIMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2S/c1-9-8-21-15(16-9)18-14(19)13-5-3-10-7-11(20-2)4-6-12(10)17-13/h3-8H,1-2H3,(H,16,18,19).
What are the key properties of 6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)quinoline-2-carboxamide?
6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)quinoline-2-carboxamide has a molecular weight of 299.36 g/mol, XLogP of 3.26, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)quinoline-2-carboxamide is sourced from PubChem (CID 35801722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).