N-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide

C15H12ClN3O2S — CID 171466566

IUPACN-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2cc(Cl)cc3cccnc23)nc1
InChIInChI=1S/C15H12ClN3O2S/c1-10-4-5-14(18-9-10)22(20,21)19-13-8-12(16)7-11-3-2-6-17-15(11)13/h2-9,19H,1H3
InChIKeyFGIDBAZNRWFZJA-UHFFFAOYSA-N
MW333.80 g/mol
LogP3.39
Rot. Bonds3

About N-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide

N-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide (PubChem CID 171466566) has the molecular formula C15H12ClN3O2S and a molecular weight of 333.80 g/mol. Its IUPAC name is N-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide
PubChem CID171466566
Molecular FormulaC15H12ClN3O2S
Molecular Weight333.80 g/mol
Exact Mass333.03
IUPAC NameN-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2cc(Cl)cc3cccnc23)nc1
InChIInChI=1S/C15H12ClN3O2S/c1-10-4-5-14(18-9-10)22(20,21)19-13-8-12(16)7-11-3-2-6-17-15(11)13/h2-9,19H,1H3
InChIKeyFGIDBAZNRWFZJA-UHFFFAOYSA-N
XLogP3.39
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.80
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide?
The IUPAC name of N-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide (CID 171466566) is N-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide.
What is the SMILES notation for N-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide?
The canonical SMILES for N-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide is Cc1ccc(S(=O)(=O)Nc2cc(Cl)cc3cccnc23)nc1.
What is the InChIKey of N-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide?
The InChIKey is FGIDBAZNRWFZJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O2S/c1-10-4-5-14(18-9-10)22(20,21)19-13-8-12(16)7-11-3-2-6-17-15(11)13/h2-9,19H,1H3.
What are the key properties of N-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide?
N-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide has a molecular weight of 333.80 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloroquinolin-8-yl)-5-methylpyridine-2-sulfonamide is sourced from PubChem (CID 171466566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).