1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine

C15H23NO2 — CID 113389061

IUPAC1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine
SMILESCNC(C)c1c(OC)cccc1OC1CCCC1
InChIInChI=1S/C15H23NO2/c1-11(16-2)15-13(17-3)9-6-10-14(15)18-12-7-4-5-8-12/h6,9-12,16H,4-5,7-8H2,1-3H3
InChIKeyBRZNIQXISZJNIW-UHFFFAOYSA-N
MW249.35 g/mol
LogP3.30
Rot. Bonds5

About 1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine

1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine (PubChem CID 113389061) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine.

Molecular Properties

Compound Name1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine
PubChem CID113389061
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine
SMILESCNC(C)c1c(OC)cccc1OC1CCCC1
InChIInChI=1S/C15H23NO2/c1-11(16-2)15-13(17-3)9-6-10-14(15)18-12-7-4-5-8-12/h6,9-12,16H,4-5,7-8H2,1-3H3
InChIKeyBRZNIQXISZJNIW-UHFFFAOYSA-N
XLogP3.30
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-fluoro-6-(3-methylcyclohexyl)oxyphenyl]-N-methylethanamine
CID 43285864
1-(2-cyclohexyloxyphenyl)-N-methylethanamine
CID 43279544
N-[2-[3-methoxy-2-[1-(methylamino)ethyl]phenoxy]ethyl]-N-methylcyclopropanamine
CID 102740278
1-[2-methoxy-6-(3-methoxypropoxy)phenyl]-N-methylethanamine
CID 113389088
1-[2-methoxy-6-(1-methylpyrazol-4-yl)oxyphenyl]-N-methylethanamine
CID 116792885
(1R)-1-(4-cyclopentyloxyphenyl)-N-methylethanamine
CID 93007238
methyl 2-cyclopentyloxy-3-methoxybenzoate
CID 117054108
(1R)-1-(3-cyclopentyloxy-4-fluorophenyl)-N-methylethanamine
CID 142399949
1-(2-cyclopentyloxy-3-fluorophenyl)-N-methylethanamine
CID 114058866
2-cyclopentyloxy-N-methylaniline
CID 130903637
1-(5-bromo-2-cycloheptyloxyphenyl)-N-methylethanamine
CID 82926596
N-[1-[2-(2-cyclobutylethoxy)-6-methoxyphenyl]ethyl]propan-1-amine
CID 106202382

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine?
The IUPAC name of 1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine (CID 113389061) is 1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine.
What is the SMILES notation for 1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine?
The canonical SMILES for 1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine is CNC(C)c1c(OC)cccc1OC1CCCC1.
What is the InChIKey of 1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine?
The InChIKey is BRZNIQXISZJNIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-11(16-2)15-13(17-3)9-6-10-14(15)18-12-7-4-5-8-12/h6,9-12,16H,4-5,7-8H2,1-3H3.
What are the key properties of 1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine?
1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine has a molecular weight of 249.35 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopentyloxy-6-methoxyphenyl)-N-methylethanamine is sourced from PubChem (CID 113389061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).