N-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide

C15H19N3O2S — CID 120724842

IUPACN-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide
SMILESCC1CNCCC1NS(=O)(=O)c1cccc2cccnc12
InChIInChI=1S/C15H19N3O2S/c1-11-10-16-9-7-13(11)18-21(19,20)14-6-2-4-12-5-3-8-17-15(12)14/h2-6,8,11,13,16,18H,7,9-10H2,1H3
InChIKeySLWDDKCKGVTRBZ-UHFFFAOYSA-N
MW305.40 g/mol
LogP1.51
Rot. Bonds3

About N-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide

N-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide (PubChem CID 120724842) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is N-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide.

Molecular Properties

Compound NameN-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide
PubChem CID120724842
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC NameN-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide
SMILESCC1CNCCC1NS(=O)(=O)c1cccc2cccnc12
InChIInChI=1S/C15H19N3O2S/c1-11-10-16-9-7-13(11)18-21(19,20)14-6-2-4-12-5-3-8-17-15(12)14/h2-6,8,11,13,16,18H,7,9-10H2,1H3
InChIKeySLWDDKCKGVTRBZ-UHFFFAOYSA-N
XLogP1.51
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide?
The IUPAC name of N-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide (CID 120724842) is N-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide.
What is the SMILES notation for N-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide?
The canonical SMILES for N-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide is CC1CNCCC1NS(=O)(=O)c1cccc2cccnc12.
What is the InChIKey of N-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide?
The InChIKey is SLWDDKCKGVTRBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-11-10-16-9-7-13(11)18-21(19,20)14-6-2-4-12-5-3-8-17-15(12)14/h2-6,8,11,13,16,18H,7,9-10H2,1H3.
What are the key properties of N-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide?
N-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide has a molecular weight of 305.40 g/mol, XLogP of 1.51, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylpiperidin-4-yl)quinoline-8-sulfonamide is sourced from PubChem (CID 120724842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).