N-(piperidin-2-ylmethyl)quinoline-5-sulfonamide

C15H19N3O2S — CID 115752247

IUPACN-(piperidin-2-ylmethyl)quinoline-5-sulfonamide
SMILESO=S(=O)(NCC1CCCCN1)c1cccc2ncccc12
InChIInChI=1S/C15H19N3O2S/c19-21(20,18-11-12-5-1-2-9-16-12)15-8-3-7-14-13(15)6-4-10-17-14/h3-4,6-8,10,12,16,18H,1-2,5,9,11H2
InChIKeyUNIVBVJMCVJWDX-UHFFFAOYSA-N
MW305.40 g/mol
LogP1.66
Rot. Bonds4

About N-(piperidin-2-ylmethyl)quinoline-5-sulfonamide

N-(piperidin-2-ylmethyl)quinoline-5-sulfonamide (PubChem CID 115752247) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is N-(piperidin-2-ylmethyl)quinoline-5-sulfonamide.

Molecular Properties

Compound NameN-(piperidin-2-ylmethyl)quinoline-5-sulfonamide
PubChem CID115752247
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC NameN-(piperidin-2-ylmethyl)quinoline-5-sulfonamide
SMILESO=S(=O)(NCC1CCCCN1)c1cccc2ncccc12
InChIInChI=1S/C15H19N3O2S/c19-21(20,18-11-12-5-1-2-9-16-12)15-8-3-7-14-13(15)6-4-10-17-14/h3-4,6-8,10,12,16,18H,1-2,5,9,11H2
InChIKeyUNIVBVJMCVJWDX-UHFFFAOYSA-N
XLogP1.66
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3,3-dimethylpiperidin-2-yl)methyl]quinoline-5-sulfonamide
CID 120666371
8-methyl-N-(pyrrolidin-2-ylmethyl)quinoline-5-sulfonamide;hydrochloride
CID 119974304
N-(pyrrolidin-2-ylmethyl)isoquinoline-5-sulfonamide
CID 11818625
N-(pyrrolidin-2-ylmethyl)-2,1,3-benzothiadiazole-4-sulfonamide
CID 62542530
N-(pyrimidin-2-ylmethyl)quinoline-5-sulfonamide
CID 166368628
2,3-dichloro-N-(pyrrolidin-2-ylmethyl)benzenesulfonamide;hydrochloride
CID 119974073
2,3-difluoro-N-(pyrrolidin-2-ylmethyl)benzenesulfonamide
CID 119974119
N-(pyrrolidin-2-ylmethyl)pyridine-2-sulfonamide;hydrochloride
CID 66570297
N-(pyrrolidin-2-ylmethyl)-1-quinolin-8-ylmethanesulfonamide
CID 119974476
N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-1H-pyrrolo[2,3-b]pyridine-3-sulfonamide
CID 104972664
N-(2-pyrrolidin-2-ylethyl)-1H-pyrrolo[2,3-b]pyridine-3-sulfonamide
CID 114794123
(1S)-N-[[(2S)-piperidin-2-yl]methyl]-1-pyridin-2-ylethanesulfonamide
CID 97162061

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-2-ylmethyl)quinoline-5-sulfonamide?
The IUPAC name of N-(piperidin-2-ylmethyl)quinoline-5-sulfonamide (CID 115752247) is N-(piperidin-2-ylmethyl)quinoline-5-sulfonamide.
What is the SMILES notation for N-(piperidin-2-ylmethyl)quinoline-5-sulfonamide?
The canonical SMILES for N-(piperidin-2-ylmethyl)quinoline-5-sulfonamide is O=S(=O)(NCC1CCCCN1)c1cccc2ncccc12.
What is the InChIKey of N-(piperidin-2-ylmethyl)quinoline-5-sulfonamide?
The InChIKey is UNIVBVJMCVJWDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c19-21(20,18-11-12-5-1-2-9-16-12)15-8-3-7-14-13(15)6-4-10-17-14/h3-4,6-8,10,12,16,18H,1-2,5,9,11H2.
What are the key properties of N-(piperidin-2-ylmethyl)quinoline-5-sulfonamide?
N-(piperidin-2-ylmethyl)quinoline-5-sulfonamide has a molecular weight of 305.40 g/mol, XLogP of 1.66, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-2-ylmethyl)quinoline-5-sulfonamide is sourced from PubChem (CID 115752247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).