(4-chlorophenyl)-phenyl-piperidin-2-ylmethanol

C18H20ClNO — CID 3064310

IUPAC(4-chlorophenyl)-phenyl-piperidin-2-ylmethanol
SMILESOC(c1ccccc1)(c1ccc(Cl)cc1)C1CCCCN1
InChIInChI=1S/C18H20ClNO/c19-16-11-9-15(10-12-16)18(21,14-6-2-1-3-7-14)17-8-4-5-13-20-17/h1-3,6-7,9-12,17,20-21H,4-5,8,13H2
InChIKeyXMOLPHXJRQYPQY-UHFFFAOYSA-N
MW301.82 g/mol
LogP3.72
Rot. Bonds3

About (4-chlorophenyl)-phenyl-piperidin-2-ylmethanol

(4-chlorophenyl)-phenyl-piperidin-2-ylmethanol (PubChem CID 3064310) has the molecular formula C18H20ClNO and a molecular weight of 301.82 g/mol. Its IUPAC name is (4-chlorophenyl)-phenyl-piperidin-2-ylmethanol.

Molecular Properties

Compound Name(4-chlorophenyl)-phenyl-piperidin-2-ylmethanol
PubChem CID3064310
Molecular FormulaC18H20ClNO
Molecular Weight301.82 g/mol
Exact Mass301.12
IUPAC Name(4-chlorophenyl)-phenyl-piperidin-2-ylmethanol
SMILESOC(c1ccccc1)(c1ccc(Cl)cc1)C1CCCCN1
InChIInChI=1S/C18H20ClNO/c19-16-11-9-15(10-12-16)18(21,14-6-2-1-3-7-14)17-8-4-5-13-20-17/h1-3,6-7,9-12,17,20-21H,4-5,8,13H2
InChIKeyXMOLPHXJRQYPQY-UHFFFAOYSA-N
XLogP3.72
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.82
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (4-chlorophenyl)-phenyl-piperidin-2-ylmethanol with MolForge

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

Launch Full Analysis

Related Compounds

alpha,alpha-Diphenyl-2-pyrrolidinemethanol borane
CID 19782534
diphenyl-[(2S)-pyrrolidin-2-yl]methanol;trimethyl(trimethylsilyloxy)silane
CID 138393439
bis(4-fluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol
CID 6544419
bis(4-methylphenyl)-pyrrolidin-2-ylmethanol
CID 14813972
cyclohexyl-phenyl-piperidin-2-ylmethanol
CID 23856895
bis(3,4-difluorophenyl)-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride
CID 45357010
dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol
CID 2733810
bis(3,5-diphenylphenyl)-[(2R)-pyrrolidin-2-yl]methanol
CID 59628921
(1S)-1-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol
CID 13068815
2-[difluoro(phenyl)methyl]azepane
CID 105483060
azepan-2-yl(diphenyl)methanamine
CID 69019093
cyclohexyl-phenyl-pyrrolidin-2-ylmethanol
CID 166041148

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-phenyl-piperidin-2-ylmethanol?
The IUPAC name of (4-chlorophenyl)-phenyl-piperidin-2-ylmethanol (CID 3064310) is (4-chlorophenyl)-phenyl-piperidin-2-ylmethanol.
What is the SMILES notation for (4-chlorophenyl)-phenyl-piperidin-2-ylmethanol?
The canonical SMILES for (4-chlorophenyl)-phenyl-piperidin-2-ylmethanol is OC(c1ccccc1)(c1ccc(Cl)cc1)C1CCCCN1.
What is the InChIKey of (4-chlorophenyl)-phenyl-piperidin-2-ylmethanol?
The InChIKey is XMOLPHXJRQYPQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO/c19-16-11-9-15(10-12-16)18(21,14-6-2-1-3-7-14)17-8-4-5-13-20-17/h1-3,6-7,9-12,17,20-21H,4-5,8,13H2.
What are the key properties of (4-chlorophenyl)-phenyl-piperidin-2-ylmethanol?
(4-chlorophenyl)-phenyl-piperidin-2-ylmethanol has a molecular weight of 301.82 g/mol, XLogP of 3.72, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-phenyl-piperidin-2-ylmethanol is sourced from PubChem (CID 3064310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).