2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine

C18H23NO2 — CID 62335577

IUPAC2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine
SMILESCCOc1cccc(OCC(NC)c2ccccc2C)c1
InChIInChI=1S/C18H23NO2/c1-4-20-15-9-7-10-16(12-15)21-13-18(19-3)17-11-6-5-8-14(17)2/h5-12,18-19H,4,13H2,1-3H3
InChIKeyADEQGVKCBDYFFC-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.73
Rot. Bonds7

About 2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine

2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine (PubChem CID 62335577) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine
PubChem CID62335577
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Name2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine
SMILESCCOc1cccc(OCC(NC)c2ccccc2C)c1
InChIInChI=1S/C18H23NO2/c1-4-20-15-9-7-10-16(12-15)21-13-18(19-3)17-11-6-5-8-14(17)2/h5-12,18-19H,4,13H2,1-3H3
InChIKeyADEQGVKCBDYFFC-UHFFFAOYSA-N
XLogP3.73
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(2-methylphenyl)-2-(2,3,5-trimethylphenoxy)ethanamine
CID 63473491
2-(3,4-dimethylphenoxy)-N-ethyl-1-(2-methylphenyl)ethanamine
CID 63474881
[1-(2-methylphenyl)-2-phenoxyethyl]hydrazine
CID 105212883
2-(2-chloro-4-methylphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine
CID 62670922
2-(3-chlorophenoxy)-1-(2-methylphenyl)ethanol
CID 115766345
3-(3-ethoxyphenoxy)-2-(methylamino)propanoic acid
CID 62337887
N-methyl-1-(2-methylphenyl)-2-[2-(2-methylpropoxy)ethoxy]ethanamine
CID 106447365
1-[2-(3-ethoxyphenoxy)phenyl]-N-methylethanamine
CID 62337869
2-(4-chloro-3-methylphenoxy)-1-(2,4-dimethylphenyl)-N-methylethanamine
CID 63498913
N-methyl-1-(2-methylphenyl)-1-(3-propoxyphenyl)methanamine
CID 115794851
(2S)-1-(3-ethoxyphenoxy)propan-2-amine
CID 79002236
ethyl 3-(3-ethoxyphenyl)-3-(methylamino)propanoate
CID 65236327

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine?
The IUPAC name of 2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine (CID 62335577) is 2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine.
What is the SMILES notation for 2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine?
The canonical SMILES for 2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine is CCOc1cccc(OCC(NC)c2ccccc2C)c1.
What is the InChIKey of 2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine?
The InChIKey is ADEQGVKCBDYFFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2/c1-4-20-15-9-7-10-16(12-15)21-13-18(19-3)17-11-6-5-8-14(17)2/h5-12,18-19H,4,13H2,1-3H3.
What are the key properties of 2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine?
2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine has a molecular weight of 285.39 g/mol, XLogP of 3.73, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxyphenoxy)-N-methyl-1-(2-methylphenyl)ethanamine is sourced from PubChem (CID 62335577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).