6-(2-phenylcyclopropyl)piperidine-3-sulfonamide

C14H20N2O2S — CID 106781587

IUPAC6-(2-phenylcyclopropyl)piperidine-3-sulfonamide
SMILESNS(=O)(=O)C1CCC(C2CC2c2ccccc2)NC1
InChIInChI=1S/C14H20N2O2S/c15-19(17,18)11-6-7-14(16-9-11)13-8-12(13)10-4-2-1-3-5-10/h1-5,11-14,16H,6-9H2,(H2,15,17,18)
InChIKeyBIPYWJHNTVTBNG-UHFFFAOYSA-N
MW280.39 g/mol
LogP1.20
Rot. Bonds3

About 6-(2-phenylcyclopropyl)piperidine-3-sulfonamide

6-(2-phenylcyclopropyl)piperidine-3-sulfonamide (PubChem CID 106781587) has the molecular formula C14H20N2O2S and a molecular weight of 280.39 g/mol. Its IUPAC name is 6-(2-phenylcyclopropyl)piperidine-3-sulfonamide.

Molecular Properties

Compound Name6-(2-phenylcyclopropyl)piperidine-3-sulfonamide
PubChem CID106781587
Molecular FormulaC14H20N2O2S
Molecular Weight280.39 g/mol
Exact Mass280.12
IUPAC Name6-(2-phenylcyclopropyl)piperidine-3-sulfonamide
SMILESNS(=O)(=O)C1CCC(C2CC2c2ccccc2)NC1
InChIInChI=1S/C14H20N2O2S/c15-19(17,18)11-6-7-14(16-9-11)13-8-12(13)10-4-2-1-3-5-10/h1-5,11-14,16H,6-9H2,(H2,15,17,18)
InChIKeyBIPYWJHNTVTBNG-UHFFFAOYSA-N
XLogP1.20
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

trans-(1R,2S)-2-phenylcyclopropane-1-sulfonamide
CID 68572736
[2-[(1S,2R)-2-phenylcyclopropyl]piperidin-4-yl]methanamine
CID 122440726
6-(oxan-3-yl)piperidine-3-sulfonamide
CID 107137734
(3R,3aS,8aS)-3-phenyl-2,3,3a,5,6,7,8,8a-octahydro-1H-cyclohepta[b]pyrrol-4-one
CID 71565216
(3S,4R)-1-cyclopropylsulfonyl-4-phenylpyrrolidin-3-amine
CID 114263407
(1S,6R)-6-phenyl-3-azabicyclo[3.2.0]heptane
CID 90760686
trans-(1R,2S)-2-phenylcyclobutane-1-sulfonyl chloride
CID 155978186
2-phenylcyclobutane-1-carboxamide
CID 132565333
(2S)-2-phenyl-7-azabicyclo[2.2.1]heptane
CID 10197910
(2S)-4-phenylpyrrolidine-2-carboxamide
CID 171062215
6-(2,3-dihydro-1-benzofuran-5-yl)piperidine-3-sulfonamide
CID 104544340
2,7-diphenyl-2,3,4a,5,6,7,8,8a-octahydro-1H-1,6-naphthyridin-4-one
CID 118630174

Frequently Asked Questions

What is the IUPAC name of 6-(2-phenylcyclopropyl)piperidine-3-sulfonamide?
The IUPAC name of 6-(2-phenylcyclopropyl)piperidine-3-sulfonamide (CID 106781587) is 6-(2-phenylcyclopropyl)piperidine-3-sulfonamide.
What is the SMILES notation for 6-(2-phenylcyclopropyl)piperidine-3-sulfonamide?
The canonical SMILES for 6-(2-phenylcyclopropyl)piperidine-3-sulfonamide is NS(=O)(=O)C1CCC(C2CC2c2ccccc2)NC1.
What is the InChIKey of 6-(2-phenylcyclopropyl)piperidine-3-sulfonamide?
The InChIKey is BIPYWJHNTVTBNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2S/c15-19(17,18)11-6-7-14(16-9-11)13-8-12(13)10-4-2-1-3-5-10/h1-5,11-14,16H,6-9H2,(H2,15,17,18).
What are the key properties of 6-(2-phenylcyclopropyl)piperidine-3-sulfonamide?
6-(2-phenylcyclopropyl)piperidine-3-sulfonamide has a molecular weight of 280.39 g/mol, XLogP of 1.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-phenylcyclopropyl)piperidine-3-sulfonamide is sourced from PubChem (CID 106781587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).