4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine

C23H31NO2 — CID 127043268

IUPAC4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine
SMILESCOc1ccc(CCN2CCC(CCc3ccccc3OC)CC2)cc1
InChIInChI=1S/C23H31NO2/c1-25-22-11-8-19(9-12-22)13-16-24-17-14-20(15-18-24)7-10-21-5-3-4-6-23(21)26-2/h3-6,8-9,11-12,20H,7,10,13-18H2,1-2H3
InChIKeySXXRDYUUZORNEK-UHFFFAOYSA-N
MW353.51 g/mol
LogP4.59
Rot. Bonds8

About 4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine

4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine (PubChem CID 127043268) has the molecular formula C23H31NO2 and a molecular weight of 353.51 g/mol. Its IUPAC name is 4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine.

Molecular Properties

Compound Name4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine
PubChem CID127043268
Molecular FormulaC23H31NO2
Molecular Weight353.51 g/mol
Exact Mass353.24
IUPAC Name4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine
SMILESCOc1ccc(CCN2CCC(CCc3ccccc3OC)CC2)cc1
InChIInChI=1S/C23H31NO2/c1-25-22-11-8-19(9-12-22)13-16-24-17-14-20(15-18-24)7-10-21-5-3-4-6-23(21)26-2/h3-6,8-9,11-12,20H,7,10,13-18H2,1-2H3
InChIKeySXXRDYUUZORNEK-UHFFFAOYSA-N
XLogP4.59
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.51
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(3-methoxyphenyl)ethyl]-4-[2-(4-methoxyphenyl)ethyl]piperidine;hydrochloride
CID 127043453
1-[2-(2-methoxyphenyl)ethyl]-4-(2-phenylethyl)piperazine;dihydrochloride
CID 155541951
1,4-bis(2-phenylethyl)piperidine
CID 86059939
2-methoxy-3-[[4-[2-(2-methoxyphenyl)ethyl]piperidin-1-yl]methyl]pyridine
CID 22678532
[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]methanesulfonamide
CID 171910981
(3S)-3-[2-(4-methoxyphenyl)ethyl]-1-methylpyrrolidine
CID 150264737
1-[2-(2-methoxyphenyl)ethyl]-4-(2-phenoxyethyl)piperidine;2-(2-methoxyphenyl)-1-[4-(2-phenoxyethyl)piperidin-1-yl]ethanone
CID 162167070
N-[(4-fluorophenyl)methyl]-1-[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]-N-methylmethanamine
CID 26407576
1-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-(4-phenylphenoxy)ethyl]piperidine
CID 54591654
4-[[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]methyl]-2H-phthalazin-1-one
CID 58188835
4-(benzhydryloxymethyl)-1-[2-(4-methoxyphenyl)ethyl]piperidine;tritiomethane
CID 159926566
(3S)-1-[2-(4-methoxyphenyl)ethyl]pyrrolidin-3-amine;hydrochloride
CID 119933968

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine?
The IUPAC name of 4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine (CID 127043268) is 4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine.
What is the SMILES notation for 4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine?
The canonical SMILES for 4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine is COc1ccc(CCN2CCC(CCc3ccccc3OC)CC2)cc1.
What is the InChIKey of 4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine?
The InChIKey is SXXRDYUUZORNEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31NO2/c1-25-22-11-8-19(9-12-22)13-16-24-17-14-20(15-18-24)7-10-21-5-3-4-6-23(21)26-2/h3-6,8-9,11-12,20H,7,10,13-18H2,1-2H3.
What are the key properties of 4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine?
4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine has a molecular weight of 353.51 g/mol, XLogP of 4.59, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methoxyphenyl)ethyl]-1-[2-(4-methoxyphenyl)ethyl]piperidine is sourced from PubChem (CID 127043268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).