[2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride

C20H26ClNO — CID 70203501

IUPAC[2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride
SMILESCl.OCc1ccccc1C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C20H25NO.ClH/c22-16-19-8-4-5-9-20(19)18-11-14-21(15-12-18)13-10-17-6-2-1-3-7-17;/h1-9,18,22H,10-16H2;1H
InChIKeyQNJYRELXJLOQRE-UHFFFAOYSA-N
MW331.89 g/mol
LogP4.02
Rot. Bonds5

About [2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride

[2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride (PubChem CID 70203501) has the molecular formula C20H26ClNO and a molecular weight of 331.89 g/mol. Its IUPAC name is [2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride.

Molecular Properties

Compound Name[2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride
PubChem CID70203501
Molecular FormulaC20H26ClNO
Molecular Weight331.89 g/mol
Exact Mass331.17
IUPAC Name[2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride
SMILESCl.OCc1ccccc1C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C20H25NO.ClH/c22-16-19-8-4-5-9-20(19)18-11-14-21(15-12-18)13-10-17-6-2-1-3-7-17;/h1-9,18,22H,10-16H2;1H
InChIKeyQNJYRELXJLOQRE-UHFFFAOYSA-N
XLogP4.02
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.89
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-phenyl-1-(2-phenylethyl)piperidine
CID 54327803
[2-(1-chloropiperidin-4-yl)phenyl]methanol
CID 88589238
1-[1-(2-phenylethyl)piperidin-4-yl]ethanol
CID 103656947
1-benzyl-4-(2-propylphenyl)piperidine
CID 143140323
hypochlorous acid;1-(2-phenylethyl)piperidin-4-amine
CID 159010718
4-[2-(4-phenylpiperidin-1-yl)ethyl]phenol
CID 14819324
1,4-bis(2-phenylethyl)piperidine
CID 86059939
1-(2-phenylethyl)-4-propan-2-ylpiperidine
CID 18683008
4-phenyl-1-(2-phenylethyl)piperidine;propanamide
CID 175431355
(R)-phenyl-[1-(2-phenylethyl)piperidin-4-yl]methanol
CID 6604770
phenyl-[3-[1-(2-phenylethyl)piperidin-4-yl]indazol-1-yl]methanone;hydrochloride
CID 14032620
N,1-bis(2-phenylethyl)piperidin-4-amine
CID 24785666

Frequently Asked Questions

What is the IUPAC name of [2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride?
The IUPAC name of [2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride (CID 70203501) is [2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride.
What is the SMILES notation for [2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride?
The canonical SMILES for [2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride is Cl.OCc1ccccc1C1CCN(CCc2ccccc2)CC1.
What is the InChIKey of [2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride?
The InChIKey is QNJYRELXJLOQRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO.ClH/c22-16-19-8-4-5-9-20(19)18-11-14-21(15-12-18)13-10-17-6-2-1-3-7-17;/h1-9,18,22H,10-16H2;1H.
What are the key properties of [2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride?
[2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride has a molecular weight of 331.89 g/mol, XLogP of 4.02, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[1-(2-phenylethyl)piperidin-4-yl]phenyl]methanol;hydrochloride is sourced from PubChem (CID 70203501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).