1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide

C18H22N2O3S2 — CID 42907960

IUPAC1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide
SMILESO=C(NCCc1cccs1)C1CCCCN1S(=O)(=O)c1ccccc1
InChIInChI=1S/C18H22N2O3S2/c21-18(19-12-11-15-7-6-14-24-15)17-10-4-5-13-20(17)25(22,23)16-8-2-1-3-9-16/h1-3,6-9,14,17H,4-5,10-13H2,(H,19,21)
InChIKeyLVHJSHPJJHGASC-UHFFFAOYSA-N
MW378.52 g/mol
LogP2.65
Rot. Bonds6

About 1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide

1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide (PubChem CID 42907960) has the molecular formula C18H22N2O3S2 and a molecular weight of 378.52 g/mol. Its IUPAC name is 1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide
PubChem CID42907960
Molecular FormulaC18H22N2O3S2
Molecular Weight378.52 g/mol
Exact Mass378.11
IUPAC Name1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide
SMILESO=C(NCCc1cccs1)C1CCCCN1S(=O)(=O)c1ccccc1
InChIInChI=1S/C18H22N2O3S2/c21-18(19-12-11-15-7-6-14-24-15)17-10-4-5-13-20(17)25(22,23)16-8-2-1-3-9-16/h1-3,6-9,14,17H,4-5,10-13H2,(H,19,21)
InChIKeyLVHJSHPJJHGASC-UHFFFAOYSA-N
XLogP2.65
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.52
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-1-(4-chlorophenyl)sulfonyl-N-(thiophen-2-ylmethyl)piperidine-2-carboxamide
CID 92865542
1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(2-thiophen-2-ylethyl)pyrrolidine-2-carboxamide
CID 42907955
1-(benzenesulfonyl)-N-[2-(methylamino)ethyl]piperidine-2-carboxamide;hydrochloride
CID 119500164
1-(benzenesulfonyl)-N-benzylpiperidine-2-carboxamide
CID 4320284
1-(benzenesulfonyl)-N-[2-(ethylamino)ethyl]pyrrolidine-2-carboxamide
CID 119509273
N-[2-[1-(benzenesulfonyl)piperidin-2-yl]ethyl]-N'-(thiophen-2-ylmethyl)oxamide
CID 18574283
1-(benzenesulfonyl)-N-prop-2-ynylpiperidine-2-carboxamide
CID 46418890
1-(benzenesulfonyl)-N-[3-(dimethylamino)propyl]piperidine-2-carboxamide
CID 78781172
N-(2-amino-2-methylpropyl)-1-(benzenesulfonyl)piperidine-2-carboxamide;hydrochloride
CID 119626015
(2S)-1-(benzenesulfonyl)-N-[2-(1H-indol-3-yl)ethyl]piperidine-2-carboxamide
CID 35769793
1-(benzenesulfonyl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]pyrrolidine-2-carboxamide
CID 75554371
1-(benzenesulfonyl)-N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]piperidine-2-carboxamide
CID 46532670

Frequently Asked Questions

What is the IUPAC name of 1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide?
The IUPAC name of 1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide (CID 42907960) is 1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide.
What is the SMILES notation for 1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide?
The canonical SMILES for 1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide is O=C(NCCc1cccs1)C1CCCCN1S(=O)(=O)c1ccccc1.
What is the InChIKey of 1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide?
The InChIKey is LVHJSHPJJHGASC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3S2/c21-18(19-12-11-15-7-6-14-24-15)17-10-4-5-13-20(17)25(22,23)16-8-2-1-3-9-16/h1-3,6-9,14,17H,4-5,10-13H2,(H,19,21).
What are the key properties of 1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide?
1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide has a molecular weight of 378.52 g/mol, XLogP of 2.65, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzenesulfonyl)-N-(2-thiophen-2-ylethyl)piperidine-2-carboxamide is sourced from PubChem (CID 42907960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).