1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine

C17H21NO2 — CID 43177778

IUPAC1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine
SMILESCOc1ccccc1CNC(C)c1ccccc1OC
InChIInChI=1S/C17H21NO2/c1-13(15-9-5-7-11-17(15)20-3)18-12-14-8-4-6-10-16(14)19-2/h4-11,13,18H,12H2,1-3H3
InChIKeyZZKRSFMTQJQIRL-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.55
Rot. Bonds6

About 1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine

1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine (PubChem CID 43177778) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine
PubChem CID43177778
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine
SMILESCOc1ccccc1CNC(C)c1ccccc1OC
InChIInChI=1S/C17H21NO2/c1-13(15-9-5-7-11-17(15)20-3)18-12-14-8-4-6-10-16(14)19-2/h4-11,13,18H,12H2,1-3H3
InChIKeyZZKRSFMTQJQIRL-UHFFFAOYSA-N
XLogP3.55
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-methoxyphenyl)methyl]propan-2-amine
CID 11458027
(1R)-N-[(2,3-difluorophenyl)methyl]-1-(2-methoxyphenyl)ethanamine
CID 81396656
2-bromo-6-[[[(1S)-1-(2-methoxyphenyl)ethyl]amino]methyl]phenol
CID 81397811
2-[1-[(2-methoxyphenyl)methylamino]ethyl]benzene-1,3-diol
CID 107710311
4-[[1-(2-methoxyphenyl)ethylamino]methyl]benzene-1,3-diol
CID 43202064
(1R)-N-[(2,5-dimethylphenyl)methyl]-1-(2-methoxyphenyl)ethanamine
CID 81397936
1-(3,5-dimethylphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine
CID 78950239
(1S)-N-[(2-ethoxyphenyl)methyl]-1-(2-methylphenyl)ethanamine
CID 28652621
(1S)-N-[(2-chloro-5-fluorophenyl)methyl]-1-(2-methoxyphenyl)ethanamine
CID 102615853
(1S)-N-[(4-fluoro-2-methylphenyl)methyl]-1-(2-methoxyphenyl)ethanamine
CID 81398001
N-(1H-indol-3-ylmethyl)-1-(2-methoxyphenyl)ethanamine
CID 60663811
(1R)-N-(1H-indol-3-ylmethyl)-1-(2-methoxyphenyl)ethanamine
CID 81389478

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine?
The IUPAC name of 1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine (CID 43177778) is 1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine?
The canonical SMILES for 1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine is COc1ccccc1CNC(C)c1ccccc1OC.
What is the InChIKey of 1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine?
The InChIKey is ZZKRSFMTQJQIRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-13(15-9-5-7-11-17(15)20-3)18-12-14-8-4-6-10-16(14)19-2/h4-11,13,18H,12H2,1-3H3.
What are the key properties of 1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine?
1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine has a molecular weight of 271.36 g/mol, XLogP of 3.55, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine is sourced from PubChem (CID 43177778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).