N-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide

C14H10ClN3OS — CID 63047841

IUPACN-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide
SMILESCc1cc(Cl)c(NC(=O)c2cscn2)c2cccnc12
InChIInChI=1S/C14H10ClN3OS/c1-8-5-10(15)13(9-3-2-4-16-12(8)9)18-14(19)11-6-20-7-17-11/h2-7H,1H3,(H,18,19)
InChIKeyWNIFPEIPZDAFHE-UHFFFAOYSA-N
MW303.77 g/mol
LogP3.91
Rot. Bonds2

About N-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide

N-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide (PubChem CID 63047841) has the molecular formula C14H10ClN3OS and a molecular weight of 303.77 g/mol. Its IUPAC name is N-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide
PubChem CID63047841
Molecular FormulaC14H10ClN3OS
Molecular Weight303.77 g/mol
Exact Mass303.02
IUPAC NameN-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide
SMILESCc1cc(Cl)c(NC(=O)c2cscn2)c2cccnc12
InChIInChI=1S/C14H10ClN3OS/c1-8-5-10(15)13(9-3-2-4-16-12(8)9)18-14(19)11-6-20-7-17-11/h2-7H,1H3,(H,18,19)
InChIKeyWNIFPEIPZDAFHE-UHFFFAOYSA-N
XLogP3.91
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.77
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chloro-6-methylphenyl)-1,3-thiazole-4-carboxamide
CID 66255718
N-(2,6-dimethylphenyl)-1,3-thiazole-4-carboxamide
CID 62045312
N-(6-chloro-8-methylquinolin-5-yl)-2-ethoxyacetamide
CID 60779334
(2S)-2-amino-N-(6-chloro-8-methylquinolin-5-yl)butanamide
CID 79024943
2-[2-[(6-chloro-8-methylquinolin-5-yl)amino]-2-oxoethoxy]acetic acid
CID 61329018
2-bromo-N-(6-chloro-8-methylquinolin-5-yl)butanamide
CID 55126113
N-(6-chloro-8-methylquinolin-5-yl)-2,2,3,3-tetrafluoropropanamide
CID 103737695
4-amino-N-(6-chloro-8-methylquinolin-5-yl)-2-methylbutanamide
CID 80543358
(2S)-2-amino-N-(6-chloro-8-methylquinolin-5-yl)-4-methylpentanamide
CID 61155650
N-(4-chloro-2-methylphenyl)-1,3-thiazole-4-carboxamide
CID 62045477
N-(6-chloro-8-methylquinolin-5-yl)-2-methylpyrrolidine-3-carboxamide
CID 79378143
6-[[(6-chloro-8-methylquinolin-5-yl)amino]methyl]pyridin-3-ol
CID 79782036

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide (CID 63047841) is N-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide is Cc1cc(Cl)c(NC(=O)c2cscn2)c2cccnc12.
What is the InChIKey of N-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide?
The InChIKey is WNIFPEIPZDAFHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3OS/c1-8-5-10(15)13(9-3-2-4-16-12(8)9)18-14(19)11-6-20-7-17-11/h2-7H,1H3,(H,18,19).
What are the key properties of N-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide?
N-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide has a molecular weight of 303.77 g/mol, XLogP of 3.91, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-8-methylquinolin-5-yl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 63047841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).