5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide

C18H17N3O4S — CID 166357898

IUPAC5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCc1c[nH]c(=O)c(C(=O)NS(=O)(=O)c2c(C)ccc3cccnc23)c1
InChIInChI=1S/C18H17N3O4S/c1-3-12-9-14(17(22)20-10-12)18(23)21-26(24,25)16-11(2)6-7-13-5-4-8-19-15(13)16/h4-10H,3H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyZEMBBSTXNIXVMN-UHFFFAOYSA-N
MW371.42 g/mol
LogP1.91
Rot. Bonds4

About 5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide

5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 166357898) has the molecular formula C18H17N3O4S and a molecular weight of 371.42 g/mol. Its IUPAC name is 5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID166357898
Molecular FormulaC18H17N3O4S
Molecular Weight371.42 g/mol
Exact Mass371.09
IUPAC Name5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCc1c[nH]c(=O)c(C(=O)NS(=O)(=O)c2c(C)ccc3cccnc23)c1
InChIInChI=1S/C18H17N3O4S/c1-3-12-9-14(17(22)20-10-12)18(23)21-26(24,25)16-11(2)6-7-13-5-4-8-19-15(13)16/h4-10H,3H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyZEMBBSTXNIXVMN-UHFFFAOYSA-N
XLogP1.91
TPSA108.99 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.42
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-bromophenyl)-N-(7-methylquinolin-8-yl)sulfonylacetamide
CID 155948071
2-(4-chlorophenyl)-N-(7-methylquinolin-8-yl)sulfonylacetamide
CID 166209694
N-[5-(hydroxymethyl)-2-methylphenyl]quinoline-8-sulfonamide
CID 3338850
5-[2-[2-[(7-methylquinolin-8-yl)sulfonylamino]phenyl]ethynyl]-4-prop-1-en-2-ylpyridine-2-carboxylic acid
CID 152516697
methyl 4-methyl-5-[2-[2-[(7-methylquinolin-8-yl)sulfonylamino]phenyl]ethynyl]pyridine-2-carboxylate
CID 148844597
7-methyl-N-[2-(methylamino)propyl]quinoline-8-sulfonamide;hydrochloride
CID 120824315
N-(6-chloroquinolin-8-yl)sulfonyl-2-oxo-1H-quinoline-3-carboxamide
CID 167977381
ethyl 2-oxo-1H-1,8-naphthyridine-3-carboxylate
CID 11564777
N-(2-ethyl-6-methylphenyl)quinoline-8-sulfonamide
CID 5218600
(3-acetylphenyl) 7-methylquinoline-8-sulfonate
CID 75448226
N-butylsulfonylquinoline-8-carboxamide
CID 102587475
2-[(7-methylquinolin-8-yl)sulfonylamino]-3-(oxolan-3-yl)propanoic acid
CID 146128051

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide (CID 166357898) is 5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide is CCc1c[nH]c(=O)c(C(=O)NS(=O)(=O)c2c(C)ccc3cccnc23)c1.
What is the InChIKey of 5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is ZEMBBSTXNIXVMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O4S/c1-3-12-9-14(17(22)20-10-12)18(23)21-26(24,25)16-11(2)6-7-13-5-4-8-19-15(13)16/h4-10H,3H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of 5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide?
5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 371.42 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(7-methylquinolin-8-yl)sulfonyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 166357898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).