N-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide

C11H20N2O3S — CID 146083111

IUPACN-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide
SMILESCS(=O)(=O)CC1CCCN(C(=O)NC2CC2)C1
InChIInChI=1S/C11H20N2O3S/c1-17(15,16)8-9-3-2-6-13(7-9)11(14)12-10-4-5-10/h9-10H,2-8H2,1H3,(H,12,14)
InChIKeyUIMVFTOJKIOUCJ-UHFFFAOYSA-N
MW260.36 g/mol
LogP0.62
Rot. Bonds3

About N-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide

N-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide (PubChem CID 146083111) has the molecular formula C11H20N2O3S and a molecular weight of 260.36 g/mol. Its IUPAC name is N-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide
PubChem CID146083111
Molecular FormulaC11H20N2O3S
Molecular Weight260.36 g/mol
Exact Mass260.12
IUPAC NameN-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide
SMILESCS(=O)(=O)CC1CCCN(C(=O)NC2CC2)C1
InChIInChI=1S/C11H20N2O3S/c1-17(15,16)8-9-3-2-6-13(7-9)11(14)12-10-4-5-10/h9-10H,2-8H2,1H3,(H,12,14)
InChIKeyUIMVFTOJKIOUCJ-UHFFFAOYSA-N
XLogP0.62
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-N-(1-methylsulfonylpiperidin-3-yl)piperidine-1-carboxamide
CID 47766211
3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide
CID 110894815
3-(aminomethyl)-N-cyclobutylpiperidine-1-carboxamide
CID 82508340
(3R)-N-cyclooctyl-3-(hydroxymethyl)piperidine-1-carboxamide
CID 95577956
4-[[3-(methoxymethyl)piperidine-1-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 106587983
(3S)-N-cyclopropyl-3-[(4-methylphenyl)methyl]piperidine-1-carboxamide
CID 94384032
2-[1-(cyclohexylcarbamoyl)piperidin-3-yl]acetic acid
CID 62690079
(3S)-3-(methylsulfonylmethyl)-N-(1,3-thiazol-2-ylmethyl)piperidine-1-carboxamide
CID 126431963
(3S)-N-(2,4-difluorophenyl)-3-(methylsulfonylmethyl)piperidine-1-carboxamide
CID 97271544
3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide
CID 51083495
3-[1-(cyclobutylcarbamoyl)piperidin-3-yl]propanoic acid
CID 62414233
[3-(methylsulfonylmethyl)piperidin-1-yl]-piperidin-4-ylmethanone;hydrochloride
CID 154910982

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide?
The IUPAC name of N-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide (CID 146083111) is N-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide.
What is the SMILES notation for N-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide?
The canonical SMILES for N-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide is CS(=O)(=O)CC1CCCN(C(=O)NC2CC2)C1.
What is the InChIKey of N-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide?
The InChIKey is UIMVFTOJKIOUCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3S/c1-17(15,16)8-9-3-2-6-13(7-9)11(14)12-10-4-5-10/h9-10H,2-8H2,1H3,(H,12,14).
What are the key properties of N-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide?
N-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide has a molecular weight of 260.36 g/mol, XLogP of 0.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide is sourced from PubChem (CID 146083111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).