5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide

C11H16ClN3O2S — CID 120725117

IUPAC5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide
SMILESCC1CNCCC1NS(=O)(=O)c1cncc(Cl)c1
InChIInChI=1S/C11H16ClN3O2S/c1-8-5-13-3-2-11(8)15-18(16,17)10-4-9(12)6-14-7-10/h4,6-8,11,13,15H,2-3,5H2,1H3
InChIKeyXBUOJPYVOFGOAT-UHFFFAOYSA-N
MW289.79 g/mol
LogP1.01
Rot. Bonds3

About 5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide

5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide (PubChem CID 120725117) has the molecular formula C11H16ClN3O2S and a molecular weight of 289.79 g/mol. Its IUPAC name is 5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide
PubChem CID120725117
Molecular FormulaC11H16ClN3O2S
Molecular Weight289.79 g/mol
Exact Mass289.07
IUPAC Name5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide
SMILESCC1CNCCC1NS(=O)(=O)c1cncc(Cl)c1
InChIInChI=1S/C11H16ClN3O2S/c1-8-5-13-3-2-11(8)15-18(16,17)10-4-9(12)6-14-7-10/h4,6-8,11,13,15H,2-3,5H2,1H3
InChIKeyXBUOJPYVOFGOAT-UHFFFAOYSA-N
XLogP1.01
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.79
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-4-methyl-N-(3-methylpiperidin-4-yl)benzenesulfonamide
CID 120725299
5-chloro-2-methyl-N-(3-methylpiperidin-4-yl)benzenesulfonamide
CID 120725193
methyl 2-chloro-4-[(3-methylpiperidin-4-yl)sulfamoyl]benzoate
CID 120724810
N-(3-methylpiperidin-4-yl)-4-phenylbenzenesulfonamide
CID 120724798
4-tert-butyl-N-(3-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120725276
4-methoxy-3,5-dimethyl-N-(3-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120725107
3,4-dichloro-N-(4-methylpiperidin-3-yl)benzenesulfonamide
CID 120722990
N-[(3R,4S)-3-methylpiperidin-4-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 124516960
3-ethyl-N-(3-methylpiperidin-4-yl)benzenesulfonamide
CID 120724850
7-chloro-2-methyl-N-(3-methylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-sulfonamide;hydrochloride
CID 120724733
2,5-dichloro-4-methoxy-N-[(3R,4S)-3-methylpiperidin-4-yl]benzenesulfonamide
CID 129467888
3-ethyl-N-(3-methylpiperidin-4-yl)benzenesulfonamide;hydrochloride
CID 120724849

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide?
The IUPAC name of 5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide (CID 120725117) is 5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide is CC1CNCCC1NS(=O)(=O)c1cncc(Cl)c1.
What is the InChIKey of 5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide?
The InChIKey is XBUOJPYVOFGOAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O2S/c1-8-5-13-3-2-11(8)15-18(16,17)10-4-9(12)6-14-7-10/h4,6-8,11,13,15H,2-3,5H2,1H3.
What are the key properties of 5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide?
5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide has a molecular weight of 289.79 g/mol, XLogP of 1.01, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(3-methylpiperidin-4-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 120725117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).