2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine

C15H23NO2 — CID 61343767

IUPAC2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine
SMILESCOc1ccc(OCC2CCCC2)c(CCN)c1
InChIInChI=1S/C15H23NO2/c1-17-14-6-7-15(13(10-14)8-9-16)18-11-12-4-2-3-5-12/h6-7,10,12H,2-5,8-9,11,16H2,1H3
InChIKeyJYVMVDZRYMRGIQ-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.77
Rot. Bonds6

About 2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine

2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine (PubChem CID 61343767) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine.

Molecular Properties

Compound Name2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine
PubChem CID61343767
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine
SMILESCOc1ccc(OCC2CCCC2)c(CCN)c1
InChIInChI=1S/C15H23NO2/c1-17-14-6-7-15(13(10-14)8-9-16)18-11-12-4-2-3-5-12/h6-7,10,12H,2-5,8-9,11,16H2,1H3
InChIKeyJYVMVDZRYMRGIQ-UHFFFAOYSA-N
XLogP2.77
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 ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(cyclopentylmethoxy)-5-methoxyphenyl]methyl]propan-1-amine
CID 61342420
3-[2-(cyclopentylmethoxy)-5-methoxyphenyl]prop-2-yn-1-amine
CID 104706862
1-[2-(cyclopropylmethoxy)-5-methoxyphenyl]-N-methylmethanamine
CID 43560073
N-[[2-(cyclopentylmethoxy)-5-methoxyphenyl]methyl]-2-methylpropan-1-amine
CID 63500325
2-[5-bromo-2-(cyclopropylmethoxy)phenyl]ethanamine
CID 60906211
2-[5-methoxy-2-(3-methoxypropoxy)phenyl]ethanamine
CID 54935989
2-[4-methoxy-2-(oxolan-3-ylmethoxy)phenyl]ethanamine
CID 54977200
2-[2-(2-aminoethyl)-4-methoxyphenoxy]acetonitrile
CID 60905751
[2-(cyclopropylmethoxymethoxy)-5-methoxyphenyl]methanamine
CID 106929092
2-[5-methoxy-2-[(4-methylphenyl)methoxy]phenyl]ethanamine
CID 60906080
2-[5-methoxy-2-(thiophen-2-ylmethoxy)phenyl]ethanamine
CID 54931143
[5-chloro-2-(cyclohexylmethoxy)phenyl]methanamine
CID 43141776

Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine?
The IUPAC name of 2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine (CID 61343767) is 2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine.
What is the SMILES notation for 2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine?
The canonical SMILES for 2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine is COc1ccc(OCC2CCCC2)c(CCN)c1.
What is the InChIKey of 2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine?
The InChIKey is JYVMVDZRYMRGIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-17-14-6-7-15(13(10-14)8-9-16)18-11-12-4-2-3-5-12/h6-7,10,12H,2-5,8-9,11,16H2,1H3.
What are the key properties of 2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine?
2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine has a molecular weight of 249.35 g/mol, XLogP of 2.77, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclopentylmethoxy)-5-methoxyphenyl]ethanamine is sourced from PubChem (CID 61343767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).