1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol

C19H22ClNO2 — CID 18649761

IUPAC1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol
SMILESO[C@@H](CN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)cc1
InChIInChI=1S/C19H22ClNO2/c20-17-8-6-15(7-9-17)18(22)14-21-12-10-19(23,11-13-21)16-4-2-1-3-5-16/h1-9,18,22-23H,10-14H2/t18-/m0/s1
InChIKeyJLRNTPVSALEDDX-SFHVURJKSA-N
MW331.84 g/mol
LogP3.36
Rot. Bonds4

About 1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol

1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol (PubChem CID 18649761) has the molecular formula C19H22ClNO2 and a molecular weight of 331.84 g/mol. Its IUPAC name is 1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol.

Molecular Properties

Compound Name1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol
PubChem CID18649761
Molecular FormulaC19H22ClNO2
Molecular Weight331.84 g/mol
Exact Mass331.13
IUPAC Name1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol
SMILESO[C@@H](CN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)cc1
InChIInChI=1S/C19H22ClNO2/c20-17-8-6-15(7-9-17)18(22)14-21-12-10-19(23,11-13-21)16-4-2-1-3-5-16/h1-9,18,22-23H,10-14H2/t18-/m0/s1
InChIKeyJLRNTPVSALEDDX-SFHVURJKSA-N
XLogP3.36
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.84
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol 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 1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol?
The IUPAC name of 1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol (CID 18649761) is 1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol.
What is the SMILES notation for 1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol?
The canonical SMILES for 1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol is O[C@@H](CN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)cc1.
What is the InChIKey of 1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol?
The InChIKey is JLRNTPVSALEDDX-SFHVURJKSA-N. The full InChI is InChI=1S/C19H22ClNO2/c20-17-8-6-15(7-9-17)18(22)14-21-12-10-19(23,11-13-21)16-4-2-1-3-5-16/h1-9,18,22-23H,10-14H2/t18-/m0/s1.
What are the key properties of 1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol?
1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol has a molecular weight of 331.84 g/mol, XLogP of 3.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]-4-phenylpiperidin-4-ol is sourced from PubChem (CID 18649761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).