2-methylsulfonylpiperidine-1-carboxamide

C7H14N2O3S — CID 141152910

IUPAC2-methylsulfonylpiperidine-1-carboxamide
SMILESCS(=O)(=O)C1CCCCN1C(N)=O
InChIInChI=1S/C7H14N2O3S/c1-13(11,12)6-4-2-3-5-9(6)7(8)10/h6H,2-5H2,1H3,(H2,8,10)
InChIKeyKXZHMXLACZQFLU-UHFFFAOYSA-N
MW206.27 g/mol
LogP-0.08
Rot. Bonds1

About 2-methylsulfonylpiperidine-1-carboxamide

2-methylsulfonylpiperidine-1-carboxamide (PubChem CID 141152910) has the molecular formula C7H14N2O3S and a molecular weight of 206.27 g/mol. Its IUPAC name is 2-methylsulfonylpiperidine-1-carboxamide.

Molecular Properties

Compound Name2-methylsulfonylpiperidine-1-carboxamide
PubChem CID141152910
Molecular FormulaC7H14N2O3S
Molecular Weight206.27 g/mol
Exact Mass206.07
IUPAC Name2-methylsulfonylpiperidine-1-carboxamide
SMILESCS(=O)(=O)C1CCCCN1C(N)=O
InChIInChI=1S/C7H14N2O3S/c1-13(11,12)6-4-2-3-5-9(6)7(8)10/h6H,2-5H2,1H3,(H2,8,10)
InChIKeyKXZHMXLACZQFLU-UHFFFAOYSA-N
XLogP-0.08
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methylsulfonylpyrrolidine-1-carboxamide
CID 54245409
tert-butyl 2-methylsulfonylpiperidine-1-carboxylate
CID 69044724
2-cyclopropylpiperidine-1-carboxamide
CID 140765289
N'-hydroxy-1-(2-methylsulfonylacetyl)piperidine-2-carboximidamide
CID 77041611
1-methylsulfonylpiperidine-2-carboxamide
CID 43236894
4-methylsulfonylpiperidine-1-carboxamide
CID 130659169
(2R)-2-(hydroxymethyl)pyrrolidine-1-carboxamide
CID 45084222
2-(dimethylamino)pyrrolidine-1-carboxamide
CID 90427643
1-carbamoyl-2-methylpiperidine-3-carboxylic acid
CID 130961604
1-[2-(1-aminoethyl)piperidin-1-yl]-2-methylsulfonylpropan-1-one
CID 112701185
2-[(2R,3S)-3-hydroxy-4-methyl-1-(methylamino)pentan-2-yl]piperidine-1-carboxamide
CID 143215220
(2S)-2-[(Z)-N'-hydroxycarbamimidoyl]piperidine-1-carboxylic acid
CID 21355915

Frequently Asked Questions

What is the IUPAC name of 2-methylsulfonylpiperidine-1-carboxamide?
The IUPAC name of 2-methylsulfonylpiperidine-1-carboxamide (CID 141152910) is 2-methylsulfonylpiperidine-1-carboxamide.
What is the SMILES notation for 2-methylsulfonylpiperidine-1-carboxamide?
The canonical SMILES for 2-methylsulfonylpiperidine-1-carboxamide is CS(=O)(=O)C1CCCCN1C(N)=O.
What is the InChIKey of 2-methylsulfonylpiperidine-1-carboxamide?
The InChIKey is KXZHMXLACZQFLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O3S/c1-13(11,12)6-4-2-3-5-9(6)7(8)10/h6H,2-5H2,1H3,(H2,8,10).
What are the key properties of 2-methylsulfonylpiperidine-1-carboxamide?
2-methylsulfonylpiperidine-1-carboxamide has a molecular weight of 206.27 g/mol, XLogP of -0.08, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylsulfonylpiperidine-1-carboxamide is sourced from PubChem (CID 141152910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).