1-methylsulfonylpiperidine-2-carboxamide

C7H14N2O3S — CID 43236894

IUPAC1-methylsulfonylpiperidine-2-carboxamide
SMILESCS(=O)(=O)N1CCCCC1C(N)=O
InChIInChI=1S/C7H14N2O3S/c1-13(11,12)9-5-3-2-4-6(9)7(8)10/h6H,2-5H2,1H3,(H2,8,10)
InChIKeyBMJFBCNEIDGVPY-UHFFFAOYSA-N
MW206.27 g/mol
LogP-0.71
Rot. Bonds2

About 1-methylsulfonylpiperidine-2-carboxamide

1-methylsulfonylpiperidine-2-carboxamide (PubChem CID 43236894) has the molecular formula C7H14N2O3S and a molecular weight of 206.27 g/mol. Its IUPAC name is 1-methylsulfonylpiperidine-2-carboxamide.

Molecular Properties

Compound Name1-methylsulfonylpiperidine-2-carboxamide
PubChem CID43236894
Molecular FormulaC7H14N2O3S
Molecular Weight206.27 g/mol
Exact Mass206.07
IUPAC Name1-methylsulfonylpiperidine-2-carboxamide
SMILESCS(=O)(=O)N1CCCCC1C(N)=O
InChIInChI=1S/C7H14N2O3S/c1-13(11,12)9-5-3-2-4-6(9)7(8)10/h6H,2-5H2,1H3,(H2,8,10)
InChIKeyBMJFBCNEIDGVPY-UHFFFAOYSA-N
XLogP-0.71
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 5-0.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(3S)-3-hydroxypyrrolidin-1-yl]-(1-methylsulfonylpiperidin-2-yl)methanone
CID 79030040
(2R)-1-tert-butylsulfonylpyrrolidine-2-carboxamide
CID 59831561
(2R)-N-cyclohexyl-1-methylsulfonylpiperidine-2-carboxamide
CID 31407568
(3S)-1-(1-methylsulfonylpiperidine-2-carbonyl)piperidine-3-carboxylic acid
CID 81119956
[(3R)-3-[(1S)-1-aminoethyl]piperidin-1-yl]-[(2R)-1-methylsulfonylpiperidin-2-yl]methanone
CID 125146980
1-methylsulfonylazepan-2-amine
CID 64560545
ethane;1-methylpiperidine-2-carboxamide
CID 143592848
[3-(hydroxymethyl)pyrrolidin-1-yl]-(1-methylsulfonylpiperidin-2-yl)methanone
CID 55065507
(2S)-1-[cyclohexyl(methyl)sulfamoyl]pyrrolidine-2-carboxamide
CID 100633794
N-(1,3-dihydroxypropan-2-yl)-1-methylsulfonylpiperidine-2-carboxamide
CID 65309919
(2S)-1-iodopiperidine-2-carboxamide
CID 154003714
N-(2-methylpropoxy)-1-methylsulfonylpiperidine-2-carboxamide
CID 115410256

Frequently Asked Questions

What is the IUPAC name of 1-methylsulfonylpiperidine-2-carboxamide?
The IUPAC name of 1-methylsulfonylpiperidine-2-carboxamide (CID 43236894) is 1-methylsulfonylpiperidine-2-carboxamide.
What is the SMILES notation for 1-methylsulfonylpiperidine-2-carboxamide?
The canonical SMILES for 1-methylsulfonylpiperidine-2-carboxamide is CS(=O)(=O)N1CCCCC1C(N)=O.
What is the InChIKey of 1-methylsulfonylpiperidine-2-carboxamide?
The InChIKey is BMJFBCNEIDGVPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O3S/c1-13(11,12)9-5-3-2-4-6(9)7(8)10/h6H,2-5H2,1H3,(H2,8,10).
What are the key properties of 1-methylsulfonylpiperidine-2-carboxamide?
1-methylsulfonylpiperidine-2-carboxamide has a molecular weight of 206.27 g/mol, XLogP of -0.71, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylsulfonylpiperidine-2-carboxamide is sourced from PubChem (CID 43236894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).