N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide

C15H24N2O3S — CID 90941820

IUPACN-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide
SMILESCS(=O)(=O)N(CC(O)CN1CCCCC1)c1ccccc1
InChIInChI=1S/C15H24N2O3S/c1-21(19,20)17(14-8-4-2-5-9-14)13-15(18)12-16-10-6-3-7-11-16/h2,4-5,8-9,15,18H,3,6-7,10-13H2,1H3
InChIKeyMZBIZPRSCZRSRF-UHFFFAOYSA-N
MW312.43 g/mol
LogP1.30
Rot. Bonds6

About N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide

N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide (PubChem CID 90941820) has the molecular formula C15H24N2O3S and a molecular weight of 312.43 g/mol. Its IUPAC name is N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide.

Molecular Properties

Compound NameN-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide
PubChem CID90941820
Molecular FormulaC15H24N2O3S
Molecular Weight312.43 g/mol
Exact Mass312.15
IUPAC NameN-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide
SMILESCS(=O)(=O)N(CC(O)CN1CCCCC1)c1ccccc1
InChIInChI=1S/C15H24N2O3S/c1-21(19,20)17(14-8-4-2-5-9-14)13-15(18)12-16-10-6-3-7-11-16/h2,4-5,8-9,15,18H,3,6-7,10-13H2,1H3
InChIKeyMZBIZPRSCZRSRF-UHFFFAOYSA-N
XLogP1.30
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.43
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylnaphthalene-2-sulfonamide
CID 3293139
N-[4-[[2-hydroxy-3-(4-phenylpiperazin-1-yl)propyl]-methylsulfonylamino]phenyl]acetamide
CID 12724068
N-(2-hydroxy-3-morpholin-4-ylpropyl)-N-phenylbenzenesulfonamide
CID 3133092
N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-(4-nitrophenyl)benzenesulfonamide;hydrochloride
CID 52998314
N-ethyl-N-(2-hydroxy-3-pyrrolidin-1-ylpropyl)benzenesulfonamide
CID 141074930
N-[(2R)-2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-4-methyl-N-phenylbenzenesulfonamide
CID 1077012
N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-4-methyl-N-phenylbenzenesulfonamide
CID 3151264
2-[4-[[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-methylsulfonylamino]phenyl]acetamide
CID 12724085
N-[(2S)-2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-N-(4-methylphenyl)benzenesulfonamide
CID 1077008
N-[2-[2-(azepan-1-yl)-1-hydroxyethyl]phenyl]-N-methylmethanesulfonamide
CID 70410988
N-(4-aminophenyl)-N-(3-carbazol-9-yl-2-hydroxypropyl)methanesulfonamide
CID 123344434
N-[4-[(2-hydroxy-3-pyrrolidin-1-ylpropyl)-(4-methylphenyl)sulfonylamino]phenyl]acetamide
CID 71945543

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide?
The IUPAC name of N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide (CID 90941820) is N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide.
What is the SMILES notation for N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide?
The canonical SMILES for N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide is CS(=O)(=O)N(CC(O)CN1CCCCC1)c1ccccc1.
What is the InChIKey of N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide?
The InChIKey is MZBIZPRSCZRSRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3S/c1-21(19,20)17(14-8-4-2-5-9-14)13-15(18)12-16-10-6-3-7-11-16/h2,4-5,8-9,15,18H,3,6-7,10-13H2,1H3.
What are the key properties of N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide?
N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide has a molecular weight of 312.43 g/mol, XLogP of 1.30, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-3-piperidin-1-ylpropyl)-N-phenylmethanesulfonamide is sourced from PubChem (CID 90941820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).