2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine

C15H25NO4 — CID 103401868

IUPAC2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine
SMILESCOCCOCCCOCC(N)c1ccccc1OC
InChIInChI=1S/C15H25NO4/c1-17-10-11-19-8-5-9-20-12-14(16)13-6-3-4-7-15(13)18-2/h3-4,6-7,14H,5,8-12,16H2,1-2H3
InChIKeyMNWCWUUEUKNKTL-UHFFFAOYSA-N
MW283.37 g/mol
LogP1.76
Rot. Bonds11

About 2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine

2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine (PubChem CID 103401868) has the molecular formula C15H25NO4 and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine.

Molecular Properties

Compound Name2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine
PubChem CID103401868
Molecular FormulaC15H25NO4
Molecular Weight283.37 g/mol
Exact Mass283.18
IUPAC Name2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine
SMILESCOCCOCCCOCC(N)c1ccccc1OC
InChIInChI=1S/C15H25NO4/c1-17-10-11-19-8-5-9-20-12-14(16)13-6-3-4-7-15(13)18-2/h3-4,6-7,14H,5,8-12,16H2,1-2H3
InChIKeyMNWCWUUEUKNKTL-UHFFFAOYSA-N
XLogP1.76
TPSA62.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxyethoxy)-1-(2-methoxyphenyl)ethanamine
CID 43184458
1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine
CID 63686924
(1S)-1-[2-[3-(2-methoxyethoxy)propoxy]phenyl]propan-1-amine
CID 103402915
1-(2,4-dimethoxyphenyl)-2-[2-(2-methoxyethoxy)ethoxy]ethanamine
CID 104560891
1-[2-(2-methoxyethoxy)phenyl]-2-propoxyethanamine
CID 104660008
(1S)-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]propan-1-amine
CID 104560938
1-[2-[3-(2-methoxyethoxy)propoxy]phenyl]ethanol
CID 103410264
(1R)-1-(2-methoxyphenyl)propan-1-amine;hydrochloride
CID 53484779
2-(2-butoxyethoxy)-1-(2,4-dimethoxyphenyl)ethanamine
CID 43127564
1-(2-ethoxyphenyl)-2-[2-(3-methoxypropoxy)ethoxy]ethanol
CID 103179644
N-[3-(2-methoxyethoxy)propyl]-1-(2-methoxyphenyl)propan-1-amine
CID 43770870
(1S)-1-(2-methoxyphenyl)ethane-1,2-diamine
CID 51699599

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine?
The IUPAC name of 2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine (CID 103401868) is 2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine.
What is the SMILES notation for 2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine?
The canonical SMILES for 2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine is COCCOCCCOCC(N)c1ccccc1OC.
What is the InChIKey of 2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine?
The InChIKey is MNWCWUUEUKNKTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO4/c1-17-10-11-19-8-5-9-20-12-14(16)13-6-3-4-7-15(13)18-2/h3-4,6-7,14H,5,8-12,16H2,1-2H3.
What are the key properties of 2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine?
2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine has a molecular weight of 283.37 g/mol, XLogP of 1.76, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine is sourced from PubChem (CID 103401868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).