N-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide

C19H14N4OS — CID 122142260

IUPACN-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
SMILESCc1ccc(NC(=O)c2cnc(-c3ccncc3)s2)c2cccnc12
InChIInChI=1S/C19H14N4OS/c1-12-4-5-15(14-3-2-8-21-17(12)14)23-18(24)16-11-22-19(25-16)13-6-9-20-10-7-13/h2-11H,1H3,(H,23,24)
InChIKeyQWBUJIXTJBRYAB-UHFFFAOYSA-N
MW346.42 g/mol
LogP4.31
Rot. Bonds3

About N-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide

N-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide (PubChem CID 122142260) has the molecular formula C19H14N4OS and a molecular weight of 346.42 g/mol. Its IUPAC name is N-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
PubChem CID122142260
Molecular FormulaC19H14N4OS
Molecular Weight346.42 g/mol
Exact Mass346.09
IUPAC NameN-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
SMILESCc1ccc(NC(=O)c2cnc(-c3ccncc3)s2)c2cccnc12
InChIInChI=1S/C19H14N4OS/c1-12-4-5-15(14-3-2-8-21-17(12)14)23-18(24)16-11-22-19(25-16)13-6-9-20-10-7-13/h2-11H,1H3,(H,23,24)
InChIKeyQWBUJIXTJBRYAB-UHFFFAOYSA-N
XLogP4.31
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.42
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1,5-dimethylpyrazol-4-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
CID 166217040
N-(2,5-dimethylphenyl)-2-phenyl-1,3-thiazole-5-carboxamide
CID 46484824
N-(8-methylquinolin-5-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide
CID 51085163
N-(8-aminoquinolin-5-yl)-5-methylthiophene-2-carboxamide
CID 104826414
2,4,6-trimethyl-N-(8-methylquinolin-5-yl)benzamide
CID 112812579
5-ethyl-N-(8-methylquinolin-5-yl)furan-2-carboxamide
CID 46404652
5-bromo-N-(8-chloroquinolin-5-yl)-4-methylthiophene-2-carboxamide
CID 79988116
N-[2-(ethylamino)ethyl]-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
CID 119505049
N-(8-methylquinolin-5-yl)-2-naphthalen-2-ylacetamide
CID 38280575
2-methyl-N-[2-[(8-methylquinolin-5-yl)carbamoylamino]ethyl]propanamide
CID 47033502
N-(8-aminoquinolin-5-yl)pyridine-2-carboxamide
CID 104826471
2-[(2-methylpropan-2-yl)oxy]-N-(8-methylquinolin-5-yl)acetamide
CID 115949975

Frequently Asked Questions

What is the IUPAC name of N-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide (CID 122142260) is N-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide is Cc1ccc(NC(=O)c2cnc(-c3ccncc3)s2)c2cccnc12.
What is the InChIKey of N-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide?
The InChIKey is QWBUJIXTJBRYAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4OS/c1-12-4-5-15(14-3-2-8-21-17(12)14)23-18(24)16-11-22-19(25-16)13-6-9-20-10-7-13/h2-11H,1H3,(H,23,24).
What are the key properties of N-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide?
N-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide has a molecular weight of 346.42 g/mol, XLogP of 4.31, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-methylquinolin-5-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 122142260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).