(2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide

C15H24N2O3S2 — CID 126435167

IUPAC(2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide
SMILESCS(=O)(=O)CCNC(=O)N1CCCC[C@@H]1CCc1cccs1
InChIInChI=1S/C15H24N2O3S2/c1-22(19,20)12-9-16-15(18)17-10-3-2-5-13(17)7-8-14-6-4-11-21-14/h4,6,11,13H,2-3,5,7-10,12H2,1H3,(H,16,18)/t13-/m1/s1
InChIKeyQVTXIWJOXSFXJD-CYBMUJFWSA-N
MW344.50 g/mol
LogP2.29
Rot. Bonds6

About (2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide

(2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide (PubChem CID 126435167) has the molecular formula C15H24N2O3S2 and a molecular weight of 344.50 g/mol. Its IUPAC name is (2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name(2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide
PubChem CID126435167
Molecular FormulaC15H24N2O3S2
Molecular Weight344.50 g/mol
Exact Mass344.12
IUPAC Name(2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide
SMILESCS(=O)(=O)CCNC(=O)N1CCCC[C@@H]1CCc1cccs1
InChIInChI=1S/C15H24N2O3S2/c1-22(19,20)12-9-16-15(18)17-10-3-2-5-13(17)7-8-14-6-4-11-21-14/h4,6,11,13H,2-3,5,7-10,12H2,1H3,(H,16,18)/t13-/m1/s1
InChIKeyQVTXIWJOXSFXJD-CYBMUJFWSA-N
XLogP2.29
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.50
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-(2-hydroxyethyl)-N-(3-thiophen-2-ylpropyl)piperidine-1-carboxamide
CID 97335931
(2R)-N-(5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide
CID 126427962
N-(5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide
CID 118766404
morpholin-4-yl-[(2S)-2-(2-thiophen-2-ylethyl)piperidin-1-yl]methanone
CID 95708561
2-methyl-6-[2-(2-thiophen-2-ylethyl)piperidine-1-carbonyl]pyridazin-3-one
CID 45229333
(2-methyl-1,3-thiazol-4-yl)-[2-(2-thiophen-2-ylethyl)piperidin-1-yl]methanone
CID 70724327
morpholin-4-yl-[4-[2-(2-thiophen-2-ylethyl)piperidine-1-carbonyl]phenyl]methanone
CID 131910259
1H-pyrrol-3-yl-[2-(2-thiophen-2-ylethyl)piperidin-1-yl]methanone
CID 131916813
6-[2-(2-thiophen-2-ylethyl)piperidine-1-carbonyl]-1H-pyrimidine-2,4-dione
CID 70733217
5-methoxy-2-[(2S)-2-(2-thiophen-2-ylethyl)piperidine-1-carbonyl]pyran-4-one
CID 97203173
(2R)-2-(benzenesulfonylmethyl)-N-(thiophen-2-ylmethyl)pyrrolidine-1-carboxamide
CID 97415022
2-[2-(2-thiophen-2-ylethyl)piperidine-1-carbonyl]benzonitrile
CID 70772329

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide?
The IUPAC name of (2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide (CID 126435167) is (2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide.
What is the SMILES notation for (2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide?
The canonical SMILES for (2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide is CS(=O)(=O)CCNC(=O)N1CCCC[C@@H]1CCc1cccs1.
What is the InChIKey of (2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide?
The InChIKey is QVTXIWJOXSFXJD-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H24N2O3S2/c1-22(19,20)12-9-16-15(18)17-10-3-2-5-13(17)7-8-14-6-4-11-21-14/h4,6,11,13H,2-3,5,7-10,12H2,1H3,(H,16,18)/t13-/m1/s1.
What are the key properties of (2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide?
(2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide has a molecular weight of 344.50 g/mol, XLogP of 2.29, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-methylsulfonylethyl)-2-(2-thiophen-2-ylethyl)piperidine-1-carboxamide is sourced from PubChem (CID 126435167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).