N-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide

C15H24N2O2S — CID 107585332

IUPACN-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide
SMILESCC1CNCC(NS(=O)(=O)CC(C)c2ccccc2)C1
InChIInChI=1S/C15H24N2O2S/c1-12-8-15(10-16-9-12)17-20(18,19)11-13(2)14-6-4-3-5-7-14/h3-7,12-13,15-17H,8-11H2,1-2H3
InChIKeyBWILLMSGLZBCFX-UHFFFAOYSA-N
MW296.44 g/mol
LogP1.71
Rot. Bonds5

About N-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide

N-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide (PubChem CID 107585332) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is N-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide.

Molecular Properties

Compound NameN-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide
PubChem CID107585332
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC NameN-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide
SMILESCC1CNCC(NS(=O)(=O)CC(C)c2ccccc2)C1
InChIInChI=1S/C15H24N2O2S/c1-12-8-15(10-16-9-12)17-20(18,19)11-13(2)14-6-4-3-5-7-14/h3-7,12-13,15-17H,8-11H2,1-2H3
InChIKeyBWILLMSGLZBCFX-UHFFFAOYSA-N
XLogP1.71
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenyl-N-[(3S)-piperidin-3-yl]propane-1-sulfonamide
CID 104982520
N-(3-hydroxycyclobutyl)-2-phenylpropane-1-sulfonamide
CID 80685896
1-cyclopropyl-N-(5-methylpiperidin-3-yl)methanesulfonamide
CID 107585329
N-(2-bromocyclopentyl)-2-phenylpropane-1-sulfonamide
CID 80686401
N-(1,3-dihydroxypropan-2-yl)-2-phenylpropane-1-sulfonamide
CID 80686550
4-methyl-N-(5-methylpiperidin-3-yl)piperidine-1-sulfonamide
CID 107585361
N-(4-aminophenyl)-2-phenylpropane-1-sulfonamide
CID 80685946
2,5-difluoro-N-(5-methylpiperidin-3-yl)benzenesulfonamide
CID 107585302
2-phenyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide
CID 80686709
N-(2-cyclopropyl-2-hydroxyethyl)-2-phenylpropane-1-sulfonamide
CID 80685968
N-ethoxy-2-phenylpropane-1-sulfonamide
CID 80686317
4-fluoro-2,6-dimethyl-N-(5-methylpiperidin-3-yl)benzenesulfonamide
CID 107585309

Frequently Asked Questions

What is the IUPAC name of N-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide?
The IUPAC name of N-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide (CID 107585332) is N-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide.
What is the SMILES notation for N-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide?
The canonical SMILES for N-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide is CC1CNCC(NS(=O)(=O)CC(C)c2ccccc2)C1.
What is the InChIKey of N-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide?
The InChIKey is BWILLMSGLZBCFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S/c1-12-8-15(10-16-9-12)17-20(18,19)11-13(2)14-6-4-3-5-7-14/h3-7,12-13,15-17H,8-11H2,1-2H3.
What are the key properties of N-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide?
N-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide has a molecular weight of 296.44 g/mol, XLogP of 1.71, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methylpiperidin-3-yl)-2-phenylpropane-1-sulfonamide is sourced from PubChem (CID 107585332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).