1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine

C14H23NO3 — CID 63686924

IUPAC1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine
SMILESCCCOCCOCC(N)c1ccccc1OC
InChIInChI=1S/C14H23NO3/c1-3-8-17-9-10-18-11-13(15)12-6-4-5-7-14(12)16-2/h4-7,13H,3,8-11,15H2,1-2H3
InChIKeySXLCDJGJYWZCRD-UHFFFAOYSA-N
MW253.34 g/mol
LogP2.14
Rot. Bonds9

About 1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine

1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine (PubChem CID 63686924) has the molecular formula C14H23NO3 and a molecular weight of 253.34 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine
PubChem CID63686924
Molecular FormulaC14H23NO3
Molecular Weight253.34 g/mol
Exact Mass253.17
IUPAC Name1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine
SMILESCCCOCCOCC(N)c1ccccc1OC
InChIInChI=1S/C14H23NO3/c1-3-8-17-9-10-18-11-13(15)12-6-4-5-7-14(12)16-2/h4-7,13H,3,8-11,15H2,1-2H3
InChIKeySXLCDJGJYWZCRD-UHFFFAOYSA-N
XLogP2.14
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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
2-[3-(2-methoxyethoxy)propoxy]-1-(2-methoxyphenyl)ethanamine
CID 103401868
1-[2-(2-methoxyethoxy)phenyl]-2-propoxyethanamine
CID 104660008
1-(2-methoxyphenyl)-N-methyl-2-(2-propoxyethoxy)ethanamine
CID 63686193
(1R)-1-(2-methoxyphenyl)propan-1-amine;hydrochloride
CID 53484779
2-ethoxy-1-(2-propoxyphenyl)ethanamine
CID 104660329
1-(3-methoxy-4-pyridinyl)-2-propoxyethanamine
CID 105065820
2-(2-butoxyethoxy)-1-(2,4-dimethoxyphenyl)ethanamine
CID 43127564
(1R)-1-[2-(2-propoxyethoxy)phenyl]ethanamine
CID 78948142
(1S)-1-(2-methoxyphenyl)ethane-1,2-diamine
CID 51699599
(1S)-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]propan-1-amine
CID 104560938
(1R)-1-(2-methoxyphenyl)-N-(2-propoxyethyl)ethanamine
CID 106452312

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine?
The IUPAC name of 1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine (CID 63686924) is 1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine.
What is the SMILES notation for 1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine?
The canonical SMILES for 1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine is CCCOCCOCC(N)c1ccccc1OC.
What is the InChIKey of 1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine?
The InChIKey is SXLCDJGJYWZCRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3/c1-3-8-17-9-10-18-11-13(15)12-6-4-5-7-14(12)16-2/h4-7,13H,3,8-11,15H2,1-2H3.
What are the key properties of 1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine?
1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine has a molecular weight of 253.34 g/mol, XLogP of 2.14, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-2-(2-propoxyethoxy)ethanamine is sourced from PubChem (CID 63686924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).