2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine

C15H23NO2 — CID 66323024

IUPAC2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine
SMILESCOc1ccc(C(N)COCC2CCCC2)cc1
InChIInChI=1S/C15H23NO2/c1-17-14-8-6-13(7-9-14)15(16)11-18-10-12-4-2-3-5-12/h6-9,12,15H,2-5,10-11,16H2,1H3
InChIKeyUPPJGDVGRNVSQS-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.90
Rot. Bonds6

About 2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine

2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine (PubChem CID 66323024) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine.

Molecular Properties

Compound Name2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine
PubChem CID66323024
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine
SMILESCOc1ccc(C(N)COCC2CCCC2)cc1
InChIInChI=1S/C15H23NO2/c1-17-14-8-6-13(7-9-14)15(16)11-18-10-12-4-2-3-5-12/h6-9,12,15H,2-5,10-11,16H2,1H3
InChIKeyUPPJGDVGRNVSQS-UHFFFAOYSA-N
XLogP2.90
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclohexylmethoxy)-1-(4-methoxyphenyl)ethanamine
CID 55066538
2-(cyclopentylmethoxy)-1-(4-propoxyphenyl)ethanamine
CID 66323892
1-(4-tert-butylphenyl)-2-(cyclopentylmethoxy)ethanamine
CID 66323254
1-(4-methoxyphenyl)-2-(oxan-2-ylmethoxy)ethanamine
CID 43184286
2-(cyclopropylmethoxy)-1-(4-propan-2-ylphenyl)ethanamine
CID 43211666
N-[2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethyl]propan-1-amine
CID 66324313
2-(cyclopropylmethoxy)-1-(4-propoxyphenyl)ethanamine
CID 43211713
2-(cyclopentylmethylsulfinyl)-1-(4-methoxyphenyl)ethanamine
CID 64657292
(1R)-2-cyclopropyl-1-(4-methoxyphenyl)ethanamine;hydrochloride
CID 171200883
1-(4-methoxyphenyl)-2-(3-methoxypropoxy)ethanamine
CID 54936821
2-cyclohexyl-1-(6-methoxynaphthalen-2-yl)ethanamine
CID 63504313
1-[1-(cyclohexylmethoxy)-2-iodoethyl]-4-methoxybenzene
CID 114773998

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine?
The IUPAC name of 2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine (CID 66323024) is 2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine.
What is the SMILES notation for 2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine?
The canonical SMILES for 2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine is COc1ccc(C(N)COCC2CCCC2)cc1.
What is the InChIKey of 2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine?
The InChIKey is UPPJGDVGRNVSQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-17-14-8-6-13(7-9-14)15(16)11-18-10-12-4-2-3-5-12/h6-9,12,15H,2-5,10-11,16H2,1H3.
What are the key properties of 2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine?
2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine has a molecular weight of 249.35 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethanamine is sourced from PubChem (CID 66323024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).