(3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide

C13H20N2O3S2 — CID 92802331

IUPAC(3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
SMILESCCCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1
InChIInChI=1S/C13H20N2O3S2/c1-2-7-14-13(16)11-5-3-8-15(10-11)20(17,18)12-6-4-9-19-12/h4,6,9,11H,2-3,5,7-8,10H2,1H3,(H,14,16)/t11-/m1/s1
InChIKeySTJARWRFYIAYCW-LLVKDONJSA-N
MW316.45 g/mol
LogP1.67
Rot. Bonds5

About (3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide

(3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide (PubChem CID 92802331) has the molecular formula C13H20N2O3S2 and a molecular weight of 316.45 g/mol. Its IUPAC name is (3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
PubChem CID92802331
Molecular FormulaC13H20N2O3S2
Molecular Weight316.45 g/mol
Exact Mass316.09
IUPAC Name(3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
SMILESCCCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1
InChIInChI=1S/C13H20N2O3S2/c1-2-7-14-13(16)11-5-3-8-15(10-11)20(17,18)12-6-4-9-19-12/h4,6,9,11H,2-3,5,7-8,10H2,1H3,(H,14,16)/t11-/m1/s1
InChIKeySTJARWRFYIAYCW-LLVKDONJSA-N
XLogP1.67
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.45
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-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

(3R)-N-(3-pyrrolidin-1-ylpropyl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 94019515
N-[2-[di(propan-2-yl)amino]ethyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 55451031
(3R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 95875459
(3S)-N-[3-(dimethylamino)propyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 38017869
N-[3-(4-methylpiperazin-1-yl)propyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 43905757
N-[3-(dimethylamino)propyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 43917011
(3S)-N-methyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 92802328
N-propyl-2-[4-(1-thiophen-2-ylsulfonylpiperidine-3-carbonyl)piperazin-1-yl]acetamide
CID 55415067
N-butan-2-yl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 51228957
(3S)-N-(2-cyclohexylsulfanylethyl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 92802318
(3R)-N-[(4-methylphenyl)methyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 7410118
N-propan-2-yl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 3239956

Frequently Asked Questions

What is the IUPAC name of (3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide?
The IUPAC name of (3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide (CID 92802331) is (3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide?
The canonical SMILES for (3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide is CCCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1.
What is the InChIKey of (3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide?
The InChIKey is STJARWRFYIAYCW-LLVKDONJSA-N. The full InChI is InChI=1S/C13H20N2O3S2/c1-2-7-14-13(16)11-5-3-8-15(10-11)20(17,18)12-6-4-9-19-12/h4,6,9,11H,2-3,5,7-8,10H2,1H3,(H,14,16)/t11-/m1/s1.
What are the key properties of (3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide?
(3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide has a molecular weight of 316.45 g/mol, XLogP of 1.67, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-propyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide is sourced from PubChem (CID 92802331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).