6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide

C14H11N3O3S — CID 62636555

IUPAC6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide
SMILESO=c1ccc(S(=O)(=O)Nc2ccc3ncccc3c2)c[nH]1
InChIInChI=1S/C14H11N3O3S/c18-14-6-4-12(9-16-14)21(19,20)17-11-3-5-13-10(8-11)2-1-7-15-13/h1-9,17H,(H,16,18)
InChIKeyKSBOTPSOUXTLPS-UHFFFAOYSA-N
MW301.33 g/mol
LogP1.72
Rot. Bonds3

About 6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide

6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide (PubChem CID 62636555) has the molecular formula C14H11N3O3S and a molecular weight of 301.33 g/mol. Its IUPAC name is 6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide
PubChem CID62636555
Molecular FormulaC14H11N3O3S
Molecular Weight301.33 g/mol
Exact Mass301.05
IUPAC Name6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide
SMILESO=c1ccc(S(=O)(=O)Nc2ccc3ncccc3c2)c[nH]1
InChIInChI=1S/C14H11N3O3S/c18-14-6-4-12(9-16-14)21(19,20)17-11-3-5-13-10(8-11)2-1-7-15-13/h1-9,17H,(H,16,18)
InChIKeyKSBOTPSOUXTLPS-UHFFFAOYSA-N
XLogP1.72
TPSA91.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.33
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dichlorophenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629126
6-oxo-N-pyridin-3-yl-1H-pyridine-3-sulfonamide
CID 43629054
N-(3-chloro-2-pyridinyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 103094687
N-(3-methylsulfinylphenyl)quinoline-6-sulfonamide
CID 154838617
2-chloro-N-quinolin-6-ylbenzenesulfonamide
CID 25040814
N-quinolin-6-ylethanesulfonamide
CID 64584546
N-(3-bromo-4-fluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 104780385
5-cyano-N-quinolin-6-ylthiophene-2-sulfonamide
CID 106268086
quinoline-6-sulfonamide
CID 23273907
2-chloro-6-fluoro-N-quinolin-6-ylbenzenesulfonamide
CID 75458673
N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629212
4-chloro-N-(3-chloro-4-quinolin-6-yloxyphenyl)benzenesulfonamide
CID 67931068

Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide?
The IUPAC name of 6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide (CID 62636555) is 6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide.
What is the SMILES notation for 6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide?
The canonical SMILES for 6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide is O=c1ccc(S(=O)(=O)Nc2ccc3ncccc3c2)c[nH]1.
What is the InChIKey of 6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide?
The InChIKey is KSBOTPSOUXTLPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O3S/c18-14-6-4-12(9-16-14)21(19,20)17-11-3-5-13-10(8-11)2-1-7-15-13/h1-9,17H,(H,16,18).
What are the key properties of 6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide?
6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide has a molecular weight of 301.33 g/mol, XLogP of 1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-quinolin-6-yl-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 62636555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).