N-(2-phenylpropyl)piperidine-3-sulfonamide

C14H22N2O2S — CID 104591796

IUPACN-(2-phenylpropyl)piperidine-3-sulfonamide
SMILESCC(CNS(=O)(=O)C1CCCNC1)c1ccccc1
InChIInChI=1S/C14H22N2O2S/c1-12(13-6-3-2-4-7-13)10-16-19(17,18)14-8-5-9-15-11-14/h2-4,6-7,12,14-16H,5,8-11H2,1H3
InChIKeyIYOCOCLBQWWWCV-UHFFFAOYSA-N
MW282.41 g/mol
LogP1.46
Rot. Bonds5

About N-(2-phenylpropyl)piperidine-3-sulfonamide

N-(2-phenylpropyl)piperidine-3-sulfonamide (PubChem CID 104591796) has the molecular formula C14H22N2O2S and a molecular weight of 282.41 g/mol. Its IUPAC name is N-(2-phenylpropyl)piperidine-3-sulfonamide.

Molecular Properties

Compound NameN-(2-phenylpropyl)piperidine-3-sulfonamide
PubChem CID104591796
Molecular FormulaC14H22N2O2S
Molecular Weight282.41 g/mol
Exact Mass282.14
IUPAC NameN-(2-phenylpropyl)piperidine-3-sulfonamide
SMILESCC(CNS(=O)(=O)C1CCCNC1)c1ccccc1
InChIInChI=1S/C14H22N2O2S/c1-12(13-6-3-2-4-7-13)10-16-19(17,18)14-8-5-9-15-11-14/h2-4,6-7,12,14-16H,5,8-11H2,1H3
InChIKeyIYOCOCLBQWWWCV-UHFFFAOYSA-N
XLogP1.46
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methoxypropyl)piperidine-3-sulfonamide
CID 102699245
2-phenyl-N-[(3S)-piperidin-3-yl]propane-1-sulfonamide
CID 104982520
N-(3-methylbutyl)piperidine-3-sulfonamide
CID 24702359
3-(benzenesulfonyl)piperidine;ethane
CID 142376077
N-(2-methyl-3-pyrrolidin-1-ylpropyl)piperidine-3-sulfonamide
CID 55141917
N-[2-(dimethylamino)-2-phenylethyl]cyclopentanesulfonamide
CID 110301928
N-benzylpyrrolidine-3-sulfonamide
CID 65420907
N-(furan-2-ylmethyl)piperidine-3-sulfonamide
CID 24690010
N-[(6-methyl-2-pyridinyl)methyl]piperidine-3-sulfonamide
CID 62307379
N-(7-methyloctyl)piperidine-3-sulfonamide
CID 107816777
N-[(5-ethylthiophen-2-yl)methyl]piperidine-3-sulfonamide
CID 106013660
N-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide
CID 54972326

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylpropyl)piperidine-3-sulfonamide?
The IUPAC name of N-(2-phenylpropyl)piperidine-3-sulfonamide (CID 104591796) is N-(2-phenylpropyl)piperidine-3-sulfonamide.
What is the SMILES notation for N-(2-phenylpropyl)piperidine-3-sulfonamide?
The canonical SMILES for N-(2-phenylpropyl)piperidine-3-sulfonamide is CC(CNS(=O)(=O)C1CCCNC1)c1ccccc1.
What is the InChIKey of N-(2-phenylpropyl)piperidine-3-sulfonamide?
The InChIKey is IYOCOCLBQWWWCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2S/c1-12(13-6-3-2-4-7-13)10-16-19(17,18)14-8-5-9-15-11-14/h2-4,6-7,12,14-16H,5,8-11H2,1H3.
What are the key properties of N-(2-phenylpropyl)piperidine-3-sulfonamide?
N-(2-phenylpropyl)piperidine-3-sulfonamide has a molecular weight of 282.41 g/mol, XLogP of 1.46, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylpropyl)piperidine-3-sulfonamide is sourced from PubChem (CID 104591796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).