2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol

C20H32N2O2 — CID 143576498

IUPAC2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol
SMILESCOc1ccc(C2CCN(CC(O)C3CCN(C)CC3)CC2)cc1
InChIInChI=1S/C20H32N2O2/c1-21-11-7-18(8-12-21)20(23)15-22-13-9-17(10-14-22)16-3-5-19(24-2)6-4-16/h3-6,17-18,20,23H,7-15H2,1-2H3
InChIKeyQIHAFFOEHAEDRA-UHFFFAOYSA-N
MW332.49 g/mol
LogP2.58
Rot. Bonds5

About 2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol

2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol (PubChem CID 143576498) has the molecular formula C20H32N2O2 and a molecular weight of 332.49 g/mol. Its IUPAC name is 2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol.

Molecular Properties

Compound Name2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol
PubChem CID143576498
Molecular FormulaC20H32N2O2
Molecular Weight332.49 g/mol
Exact Mass332.25
IUPAC Name2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol
SMILESCOc1ccc(C2CCN(CC(O)C3CCN(C)CC3)CC2)cc1
InChIInChI=1S/C20H32N2O2/c1-21-11-7-18(8-12-21)20(23)15-22-13-9-17(10-14-22)16-3-5-19(24-2)6-4-16/h3-6,17-18,20,23H,7-15H2,1-2H3
InChIKeyQIHAFFOEHAEDRA-UHFFFAOYSA-N
XLogP2.58
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 5656
Venlafaxine Hydrochloride
CID 62923
UK 78282
CID 656768
(S)-Venlafaxine
CID 11846746
Venlafaxine, (R)-
CID 9795623
4-(Ethyl(2-(4-methoxyphenyl)-1-methylethyl)amino)-1-butanol
CID 26649
[1-[[4-(1-Propan-2-ylpiperidin-4-yl)oxyphenyl]methyl]piperidin-4-yl]methanol
CID 9946194
1-[3-[4-[4-(3-Piperidin-1-ylpropoxy)phenyl]phenoxy]propyl]piperidine
CID 11949667
4-[4-[4-(3-Piperidin-1-ylpropoxy)phenyl]cyclohexyl]morpholine
CID 11977494
1-{3-[4-(1-Hydroxy-1-propylbutyl)-phenoxy]propyl}piperidine
CID 11978735
N,N-dimethyl-4-[4-(3-piperidin-1-ylpropoxy)phenyl]cyclohexan-1-amine
CID 11978858
1-(3-Fluoro-4-methoxyphenyl)-3-(morpholin-4-yl)-2-phenylpropan-1-ol--hydrogen chloride (1/1)
CID 3066418

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol?
The IUPAC name of 2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol (CID 143576498) is 2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol.
What is the SMILES notation for 2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol?
The canonical SMILES for 2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol is COc1ccc(C2CCN(CC(O)C3CCN(C)CC3)CC2)cc1.
What is the InChIKey of 2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol?
The InChIKey is QIHAFFOEHAEDRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O2/c1-21-11-7-18(8-12-21)20(23)15-22-13-9-17(10-14-22)16-3-5-19(24-2)6-4-16/h3-6,17-18,20,23H,7-15H2,1-2H3.
What are the key properties of 2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol?
2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol has a molecular weight of 332.49 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-methoxyphenyl)piperidin-1-yl]-1-(1-methylpiperidin-4-yl)ethanol is sourced from PubChem (CID 143576498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).