4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine

C20H25NO — CID 142656770

IUPAC4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine
SMILESc1ccc(COc2ccccc2CCC2CCNCC2)cc1
InChIInChI=1S/C20H25NO/c1-2-6-18(7-3-1)16-22-20-9-5-4-8-19(20)11-10-17-12-14-21-15-13-17/h1-9,17,21H,10-16H2
InChIKeyKWLKSHYMCKKRQL-UHFFFAOYSA-N
MW295.43 g/mol
LogP4.20
Rot. Bonds6

About 4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine

4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine (PubChem CID 142656770) has the molecular formula C20H25NO and a molecular weight of 295.43 g/mol. Its IUPAC name is 4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine.

Molecular Properties

Compound Name4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine
PubChem CID142656770
Molecular FormulaC20H25NO
Molecular Weight295.43 g/mol
Exact Mass295.19
IUPAC Name4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine
SMILESc1ccc(COc2ccccc2CCC2CCNCC2)cc1
InChIInChI=1S/C20H25NO/c1-2-6-18(7-3-1)16-22-20-9-5-4-8-19(20)11-10-17-12-14-21-15-13-17/h1-9,17,21H,10-16H2
InChIKeyKWLKSHYMCKKRQL-UHFFFAOYSA-N
XLogP4.20
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[3-[2-[(4-chlorophenyl)methoxy]phenyl]propyl]piperidine
CID 160587805
2-phenylmethoxy-6-(piperidin-4-ylmethyl)phenol
CID 117479063
4-[(2-phenylmethoxyphenoxy)methyl]piperidine;hydrochloride
CID 164512463
3-(2-phenylmethoxyphenyl)-5-(2-piperidin-4-ylethyl)-1,2,4-oxadiazole
CID 120839849
N-[[2-[(4-fluorophenyl)methoxy]phenyl]methyl]-1-piperidin-4-ylmethanamine;dihydrochloride
CID 17155048
4-[2-(2-propylphenoxy)ethyl]piperidine
CID 56830188
4-[3-(2-methoxyphenyl)propyl]piperidine
CID 22751111
1-(4-cyclohexyl-3-methylbutyl)-2-phenylmethoxybenzene
CID 158571667
N-phenylmethoxy-1-piperidin-4-ylmethanamine
CID 82709378
2-(2-phenylmethoxyphenyl)azetidine
CID 130043680
3-[3-[2-[(4-chlorophenyl)methoxy]phenyl]propyl]azetidine
CID 159672639
N-[(3R,4R)-3-hydroxypiperidin-4-yl]-2-(2-phenylmethoxyphenyl)acetamide;hydrochloride
CID 154897273

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine?
The IUPAC name of 4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine (CID 142656770) is 4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine.
What is the SMILES notation for 4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine?
The canonical SMILES for 4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine is c1ccc(COc2ccccc2CCC2CCNCC2)cc1.
What is the InChIKey of 4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine?
The InChIKey is KWLKSHYMCKKRQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO/c1-2-6-18(7-3-1)16-22-20-9-5-4-8-19(20)11-10-17-12-14-21-15-13-17/h1-9,17,21H,10-16H2.
What are the key properties of 4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine?
4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine has a molecular weight of 295.43 g/mol, XLogP of 4.20, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-phenylmethoxyphenyl)ethyl]piperidine is sourced from PubChem (CID 142656770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).