[2-[3-(methoxymethyl)phenoxy]phenyl]methanamine

C15H17NO2 — CID 63986542

IUPAC[2-[3-(methoxymethyl)phenoxy]phenyl]methanamine
SMILESCOCc1cccc(Oc2ccccc2CN)c1
InChIInChI=1S/C15H17NO2/c1-17-11-12-5-4-7-14(9-12)18-15-8-3-2-6-13(15)10-16/h2-9H,10-11,16H2,1H3
InChIKeyVNJIKNXSIVLAGV-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.08
Rot. Bonds5

About [2-[3-(methoxymethyl)phenoxy]phenyl]methanamine

[2-[3-(methoxymethyl)phenoxy]phenyl]methanamine (PubChem CID 63986542) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is [2-[3-(methoxymethyl)phenoxy]phenyl]methanamine.

Molecular Properties

Compound Name[2-[3-(methoxymethyl)phenoxy]phenyl]methanamine
PubChem CID63986542
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name[2-[3-(methoxymethyl)phenoxy]phenyl]methanamine
SMILESCOCc1cccc(Oc2ccccc2CN)c1
InChIInChI=1S/C15H17NO2/c1-17-11-12-5-4-7-14(9-12)18-15-8-3-2-6-13(15)10-16/h2-9H,10-11,16H2,1H3
InChIKeyVNJIKNXSIVLAGV-UHFFFAOYSA-N
XLogP3.08
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[3-(methoxymethyl)phenoxy]-5-methylphenyl]methanamine
CID 107926521
[2-[(3-methoxyphenyl)methoxy]phenyl]methanamine
CID 19627406
(1R)-1-[2-[3-(methoxymethyl)phenoxy]phenyl]ethanamine
CID 63986581
ethyl 2-[3-[2-(aminomethyl)phenoxy]phenyl]acetate
CID 54494277
[2-[3-(aminomethyl)phenoxy]phenyl]methanol
CID 63942730
[2-(3-methylsulfonylphenoxy)phenyl]methanamine
CID 43806812
[2-(3-bromophenoxy)phenyl]methanamine
CID 28966197
[3-[3-(methoxymethyl)phenoxy]pyridazin-4-yl]methanamine
CID 80508065
1-[2-fluoro-6-[3-(methoxymethyl)phenoxy]phenyl]ethanamine
CID 63986975
[2-[3-(trifluoromethyl)phenoxy]phenyl]methanamine
CID 19627404
[3-(methoxymethyl)phenyl]methanamine
CID 16787292
2-amino-3-[3-(methoxymethyl)phenoxy]benzamide
CID 115547294

Frequently Asked Questions

What is the IUPAC name of [2-[3-(methoxymethyl)phenoxy]phenyl]methanamine?
The IUPAC name of [2-[3-(methoxymethyl)phenoxy]phenyl]methanamine (CID 63986542) is [2-[3-(methoxymethyl)phenoxy]phenyl]methanamine.
What is the SMILES notation for [2-[3-(methoxymethyl)phenoxy]phenyl]methanamine?
The canonical SMILES for [2-[3-(methoxymethyl)phenoxy]phenyl]methanamine is COCc1cccc(Oc2ccccc2CN)c1.
What is the InChIKey of [2-[3-(methoxymethyl)phenoxy]phenyl]methanamine?
The InChIKey is VNJIKNXSIVLAGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-17-11-12-5-4-7-14(9-12)18-15-8-3-2-6-13(15)10-16/h2-9H,10-11,16H2,1H3.
What are the key properties of [2-[3-(methoxymethyl)phenoxy]phenyl]methanamine?
[2-[3-(methoxymethyl)phenoxy]phenyl]methanamine has a molecular weight of 243.31 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[3-(methoxymethyl)phenoxy]phenyl]methanamine is sourced from PubChem (CID 63986542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).