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

N-(3,5-dimethoxyphenyl)-4-[1-hydroxy-2-[4-(4-methoxyphenyl)piperidin-1-yl]ethyl]piperidine-1-carbothioamide
CID 58950808
1-[3-(4-methoxyphenyl)pyrrolidin-1-yl]-3-(4-methylpiperidin-1-yl)propan-2-ol
CID 111106170
1-[4-[1-hydroxy-2-[4-(4-methoxyphenyl)piperidin-1-yl]ethyl]piperidin-1-yl]-3-(3-methylphenyl)prop-2-en-1-one
CID 69407253
3-[4-(4-methoxyphenyl)piperidin-1-yl]propan-1-amine
CID 94689546
5-[4-(4-methoxyphenyl)piperidin-1-yl]pentanenitrile
CID 71985476
3-(4-methoxyphenyl)-1-methylazetidine
CID 134399978
2-(4,4-dimethylpiperidin-1-yl)-1-(1-methylpiperidin-4-yl)ethanol
CID 76828432
1-[4-(2-cyclopropyl-2-hydroxyethyl)piperazin-1-yl]-2-(4-methoxyphenyl)ethanone
CID 71783108
3-(3,5-difluorophenyl)-1-[4-[1-hydroxy-3-[4-(4-methoxyphenyl)piperidin-1-yl]propan-2-yl]piperidin-1-yl]prop-2-en-1-one
CID 69450143
4-[4-(4-methoxyphenyl)piperidin-1-yl]butanehydrazide
CID 54235113
(2R)-4-[2-[4-(4-methoxyphenyl)piperidin-1-yl]ethyl]-2-methylmorpholine
CID 124737887
1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol
CID 58103926

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).