N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide

C15H19N3O2S2 — CID 131922128

IUPACN-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide
SMILESO=S(=O)(NC1CCCN(Cc2cccs2)C1)c1cccnc1
InChIInChI=1S/C15H19N3O2S2/c19-22(20,15-6-1-7-16-10-15)17-13-4-2-8-18(11-13)12-14-5-3-9-21-14/h1,3,5-7,9-10,13,17H,2,4,8,11-12H2
InChIKeyAASIVVSFKKMRPX-UHFFFAOYSA-N
MW337.47 g/mol
LogP2.09
Rot. Bonds5

About N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide

N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide (PubChem CID 131922128) has the molecular formula C15H19N3O2S2 and a molecular weight of 337.47 g/mol. Its IUPAC name is N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide
PubChem CID131922128
Molecular FormulaC15H19N3O2S2
Molecular Weight337.47 g/mol
Exact Mass337.09
IUPAC NameN-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide
SMILESO=S(=O)(NC1CCCN(Cc2cccs2)C1)c1cccnc1
InChIInChI=1S/C15H19N3O2S2/c19-22(20,15-6-1-7-16-10-15)17-13-4-2-8-18(11-13)12-14-5-3-9-21-14/h1,3,5-7,9-10,13,17H,2,4,8,11-12H2
InChIKeyAASIVVSFKKMRPX-UHFFFAOYSA-N
XLogP2.09
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.47
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]-1H-pyrazole-4-sulfonamide
CID 131904796
4-[[1-(thiophen-2-ylmethyl)piperidin-3-yl]sulfamoyl]benzamide
CID 131920401
N-[1-[[4-(2-methylpropyl)phenyl]methyl]piperidin-3-yl]pyridine-3-sulfonamide
CID 56918189
4-(difluoromethoxy)-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]benzenesulfonamide
CID 131935000
N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]azepane-1-sulfonamide
CID 131895476
1-pyridin-3-ylsulfonyl-4-(thiophen-2-ylmethyl)-1,4-diazepane
CID 131936945
N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide
CID 124603595
N-(3-methylcyclohexyl)pyridine-3-sulfonamide
CID 47331340
1-phenyl-N-[(3S)-1-(pyridin-3-ylmethyl)piperidin-3-yl]methanesulfonamide
CID 125441693
N-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]benzenesulfonamide
CID 75375180
4-sulfamoyl-N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]butanamide
CID 131929491
3-(pyridin-3-ylsulfonylamino)cyclohexane-1-carboxylic acid
CID 55145962

Frequently Asked Questions

What is the IUPAC name of N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide?
The IUPAC name of N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide (CID 131922128) is N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide.
What is the SMILES notation for N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide?
The canonical SMILES for N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide is O=S(=O)(NC1CCCN(Cc2cccs2)C1)c1cccnc1.
What is the InChIKey of N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide?
The InChIKey is AASIVVSFKKMRPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S2/c19-22(20,15-6-1-7-16-10-15)17-13-4-2-8-18(11-13)12-14-5-3-9-21-14/h1,3,5-7,9-10,13,17H,2,4,8,11-12H2.
What are the key properties of N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide?
N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide has a molecular weight of 337.47 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide is sourced from PubChem (CID 131922128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).