1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine

C15H23NO3 — CID 104749121

IUPAC1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine
SMILESCOc1cc(OC)cc(OCC(N)C2CCCC2)c1
InChIInChI=1S/C15H23NO3/c1-17-12-7-13(18-2)9-14(8-12)19-10-15(16)11-5-3-4-6-11/h7-9,11,15H,3-6,10,16H2,1-2H3
InChIKeyGZEYDRQSKPJLDZ-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.60
Rot. Bonds6

About 1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine

1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine (PubChem CID 104749121) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine.

Molecular Properties

Compound Name1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine
PubChem CID104749121
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine
SMILESCOc1cc(OC)cc(OCC(N)C2CCCC2)c1
InChIInChI=1S/C15H23NO3/c1-17-12-7-13(18-2)9-14(8-12)19-10-15(16)11-5-3-4-6-11/h7-9,11,15H,3-6,10,16H2,1-2H3
InChIKeyGZEYDRQSKPJLDZ-UHFFFAOYSA-N
XLogP2.60
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopentyl-2-(3,4,5-trimethoxyphenoxy)ethanamine
CID 104749742
1-cyclopentyl-2-(3-ethoxyphenoxy)ethanamine
CID 104749344
1-cyclopentyl-2-(3,4-dimethylphenoxy)ethanamine
CID 104748507
cyclooctyl-(3,5-dimethoxyphenyl)methanamine
CID 80603608
1-cyclopentyl-2-(2,3,5,6-tetrafluorophenoxy)ethanamine
CID 103289339
1-cyclohexyl-2-[4-(2-methoxyethyl)phenoxy]ethanamine
CID 104749060
1-(1-ethylpiperidin-4-yl)-2-(4-methoxyphenoxy)ethanamine
CID 117238940
2-(1,3-benzodioxol-5-yloxy)-1-cyclopentylethanamine
CID 104748816
3-(2-amino-2-cyclobutylethoxy)phenol
CID 117245581
1-cyclohexyl-2-(2,4-dimethylphenoxy)ethanamine
CID 104748372
2-(3-bromophenoxy)-1-cyclobutylethanamine
CID 117245578
(1R,2S)-2-amino-1-cyclohexyl-2-(3,5-dimethoxyphenyl)ethanol
CID 171162272

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine?
The IUPAC name of 1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine (CID 104749121) is 1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine.
What is the SMILES notation for 1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine?
The canonical SMILES for 1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine is COc1cc(OC)cc(OCC(N)C2CCCC2)c1.
What is the InChIKey of 1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine?
The InChIKey is GZEYDRQSKPJLDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-17-12-7-13(18-2)9-14(8-12)19-10-15(16)11-5-3-4-6-11/h7-9,11,15H,3-6,10,16H2,1-2H3.
What are the key properties of 1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine?
1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine has a molecular weight of 265.35 g/mol, XLogP of 2.60, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-(3,5-dimethoxyphenoxy)ethanamine is sourced from PubChem (CID 104749121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).