2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine

C16H19NO2 — CID 115464876

IUPAC2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine
SMILESCOc1ccccc1OCc1ccccc1CCN
InChIInChI=1S/C16H19NO2/c1-18-15-8-4-5-9-16(15)19-12-14-7-3-2-6-13(14)10-11-17/h2-9H,10-12,17H2,1H3
InChIKeyOMZYBVDIFSSLAJ-UHFFFAOYSA-N
MW257.33 g/mol
LogP2.78
Rot. Bonds6

About 2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine

2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine (PubChem CID 115464876) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine.

Molecular Properties

Compound Name2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine
PubChem CID115464876
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine
SMILESCOc1ccccc1OCc1ccccc1CCN
InChIInChI=1S/C16H19NO2/c1-18-15-8-4-5-9-16(15)19-12-14-7-3-2-6-13(14)10-11-17/h2-9H,10-12,17H2,1H3
InChIKeyOMZYBVDIFSSLAJ-UHFFFAOYSA-N
XLogP2.78
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxyphenyl)ethanamine;hydrochloride
CID 12626553
2-[2-[(2,3-dimethylphenoxy)methyl]phenyl]ethanamine
CID 115464752
2-[3-methoxy-2-[2-(2-methoxyphenoxy)ethoxy]phenyl]ethanamine
CID 20993640
2-[2-[(5-fluoro-2-methylphenoxy)methyl]phenyl]ethanamine
CID 102986586
2-[2-(phenoxymethyl)phenyl]ethanamine
CID 113314861
3-methoxy-4-[(2-methoxyphenyl)methoxy]aniline
CID 22112878
2-[2-[(4-chloro-2-methylphenoxy)methyl]phenyl]ethanamine
CID 115464889
2-[2-[(2,4-dichlorophenoxy)methyl]phenyl]ethanamine
CID 115464873
2-[2-[(2-chloro-4-fluorophenoxy)methyl]phenyl]ethanamine
CID 115464688
2-(2-bromo-3-methoxyphenyl)ethanamine
CID 83711367
1-iodo-2-[(2-methoxyphenyl)methoxy]benzene
CID 54942072
[2-[(2-methoxyphenoxy)methyl]-3-pyridinyl]methanamine
CID 114199233

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine?
The IUPAC name of 2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine (CID 115464876) is 2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine.
What is the SMILES notation for 2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine?
The canonical SMILES for 2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine is COc1ccccc1OCc1ccccc1CCN.
What is the InChIKey of 2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine?
The InChIKey is OMZYBVDIFSSLAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-18-15-8-4-5-9-16(15)19-12-14-7-3-2-6-13(14)10-11-17/h2-9H,10-12,17H2,1H3.
What are the key properties of 2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine?
2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine has a molecular weight of 257.33 g/mol, XLogP of 2.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine is sourced from PubChem (CID 115464876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).