(2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide

C11H20N2O3S — CID 103807849

IUPAC(2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide
SMILESCN(C(=O)[C@@H]1CCCCN1)C1CCS(=O)(=O)C1
InChIInChI=1S/C11H20N2O3S/c1-13(9-5-7-17(15,16)8-9)11(14)10-4-2-3-6-12-10/h9-10,12H,2-8H2,1H3/t9?,10-/m0/s1
InChIKeyFGIZNUTZVONXTO-AXDSSHIGSA-N
MW260.36 g/mol
LogP-0.23
Rot. Bonds2

About (2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide

(2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide (PubChem CID 103807849) has the molecular formula C11H20N2O3S and a molecular weight of 260.36 g/mol. Its IUPAC name is (2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide
PubChem CID103807849
Molecular FormulaC11H20N2O3S
Molecular Weight260.36 g/mol
Exact Mass260.12
IUPAC Name(2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide
SMILESCN(C(=O)[C@@H]1CCCCN1)C1CCS(=O)(=O)C1
InChIInChI=1S/C11H20N2O3S/c1-13(9-5-7-17(15,16)8-9)11(14)10-4-2-3-6-12-10/h9-10,12H,2-8H2,1H3/t9?,10-/m0/s1
InChIKeyFGIZNUTZVONXTO-AXDSSHIGSA-N
XLogP-0.23
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-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)-N-(1,1-dioxothiolan-3-yl)-N-methylpyrrolidine-2-carboxamide
CID 22691367
(2R)-N-butyl-N-(1,1-dioxothiolan-3-yl)piperidine-2-carboxamide
CID 104913271
N-(1,1-dioxothiolan-3-yl)-N-methyl-2-piperidin-2-ylacetamide
CID 43648898
(2S)-N-cyclohexyl-N-methylpyrrolidine-2-carboxamide
CID 23520170
N-(1,1-dioxothiolan-3-yl)-N-(2-methoxyethyl)azepane-2-carboxamide
CID 64562839
N-methyl-N-(thian-4-yl)piperidine-2-carboxamide
CID 121203607
N-methyl-N-(oxan-4-yl)piperidine-2-carboxamide
CID 43611075
(2R)-N-methyl-N-(1-methylpiperidin-3-yl)piperidine-2-carboxamide
CID 104913856
N-(1,1-dioxothiolan-3-yl)-4-methoxy-N-methylpyrrolidine-2-carboxamide
CID 61214617
(2S)-N-(4-ethylcyclohexyl)-N-methylpiperidine-2-carboxamide
CID 93456348
N-methyl-N-(oxolan-3-yl)piperidine-2-carboxamide
CID 82738037
N-cyclobutyl-N-methylazetidine-2-carboxamide
CID 130908967

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide?
The IUPAC name of (2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide (CID 103807849) is (2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide.
What is the SMILES notation for (2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide?
The canonical SMILES for (2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide is CN(C(=O)[C@@H]1CCCCN1)C1CCS(=O)(=O)C1.
What is the InChIKey of (2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide?
The InChIKey is FGIZNUTZVONXTO-AXDSSHIGSA-N. The full InChI is InChI=1S/C11H20N2O3S/c1-13(9-5-7-17(15,16)8-9)11(14)10-4-2-3-6-12-10/h9-10,12H,2-8H2,1H3/t9?,10-/m0/s1.
What are the key properties of (2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide?
(2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide has a molecular weight of 260.36 g/mol, XLogP of -0.23, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(1,1-dioxothiolan-3-yl)-N-methylpiperidine-2-carboxamide is sourced from PubChem (CID 103807849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).