4-chloro-N-methylquinoline-3-sulfonamide

C10H9ClN2O2S — CID 15643029

IUPAC4-chloro-N-methylquinoline-3-sulfonamide
SMILESCNS(=O)(=O)c1cnc2ccccc2c1Cl
InChIInChI=1S/C10H9ClN2O2S/c1-12-16(14,15)9-6-13-8-5-3-2-4-7(8)10(9)11/h2-6,12H,1H3
InChIKeyUJQCQZOIUDCZJE-UHFFFAOYSA-N
MW256.71 g/mol
LogP1.80
Rot. Bonds2

About 4-chloro-N-methylquinoline-3-sulfonamide

4-chloro-N-methylquinoline-3-sulfonamide (PubChem CID 15643029) has the molecular formula C10H9ClN2O2S and a molecular weight of 256.71 g/mol. Its IUPAC name is 4-chloro-N-methylquinoline-3-sulfonamide.

Molecular Properties

Compound Name4-chloro-N-methylquinoline-3-sulfonamide
PubChem CID15643029
Molecular FormulaC10H9ClN2O2S
Molecular Weight256.71 g/mol
Exact Mass256.01
IUPAC Name4-chloro-N-methylquinoline-3-sulfonamide
SMILESCNS(=O)(=O)c1cnc2ccccc2c1Cl
InChIInChI=1S/C10H9ClN2O2S/c1-12-16(14,15)9-6-13-8-5-3-2-4-7(8)10(9)11/h2-6,12H,1H3
InChIKeyUJQCQZOIUDCZJE-UHFFFAOYSA-N
XLogP1.80
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.71
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-methylquinoline-3-sulfonamide?
The IUPAC name of 4-chloro-N-methylquinoline-3-sulfonamide (CID 15643029) is 4-chloro-N-methylquinoline-3-sulfonamide.
What is the SMILES notation for 4-chloro-N-methylquinoline-3-sulfonamide?
The canonical SMILES for 4-chloro-N-methylquinoline-3-sulfonamide is CNS(=O)(=O)c1cnc2ccccc2c1Cl.
What is the InChIKey of 4-chloro-N-methylquinoline-3-sulfonamide?
The InChIKey is UJQCQZOIUDCZJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O2S/c1-12-16(14,15)9-6-13-8-5-3-2-4-7(8)10(9)11/h2-6,12H,1H3.
What are the key properties of 4-chloro-N-methylquinoline-3-sulfonamide?
4-chloro-N-methylquinoline-3-sulfonamide has a molecular weight of 256.71 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-methylquinoline-3-sulfonamide is sourced from PubChem (CID 15643029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).