N-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide

C19H24N2O3S — CID 21327224

IUPACN-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide
SMILESCN1CCC(O)(c2ccccc2)C(NS(=O)(=O)Cc2ccccc2)C1
InChIInChI=1S/C19H24N2O3S/c1-21-13-12-19(22,17-10-6-3-7-11-17)18(14-21)20-25(23,24)15-16-8-4-2-5-9-16/h2-11,18,20,22H,12-15H2,1H3
InChIKeySQFUMYRZIZUSNF-UHFFFAOYSA-N
MW360.48 g/mol
LogP1.70
Rot. Bonds5

About N-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide

N-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide (PubChem CID 21327224) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide.

Molecular Properties

Compound NameN-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide
PubChem CID21327224
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC NameN-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide
SMILESCN1CCC(O)(c2ccccc2)C(NS(=O)(=O)Cc2ccccc2)C1
InChIInChI=1S/C19H24N2O3S/c1-21-13-12-19(22,17-10-6-3-7-11-17)18(14-21)20-25(23,24)15-16-8-4-2-5-9-16/h2-11,18,20,22H,12-15H2,1H3
InChIKeySQFUMYRZIZUSNF-UHFFFAOYSA-N
XLogP1.70
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide?
The IUPAC name of N-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide (CID 21327224) is N-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide.
What is the SMILES notation for N-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide?
The canonical SMILES for N-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide is CN1CCC(O)(c2ccccc2)C(NS(=O)(=O)Cc2ccccc2)C1.
What is the InChIKey of N-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide?
The InChIKey is SQFUMYRZIZUSNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-21-13-12-19(22,17-10-6-3-7-11-17)18(14-21)20-25(23,24)15-16-8-4-2-5-9-16/h2-11,18,20,22H,12-15H2,1H3.
What are the key properties of N-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide?
N-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide has a molecular weight of 360.48 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-1-methyl-4-phenylpiperidin-3-yl)-1-phenylmethanesulfonamide is sourced from PubChem (CID 21327224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).