2-[2-(phenoxymethyl)phenyl]ethanamine

C15H17NO — CID 113314861

IUPAC2-[2-(phenoxymethyl)phenyl]ethanamine
SMILESNCCc1ccccc1COc1ccccc1
InChIInChI=1S/C15H17NO/c16-11-10-13-6-4-5-7-14(13)12-17-15-8-2-1-3-9-15/h1-9H,10-12,16H2
InChIKeyATKVWVLVVQMVPT-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.77
Rot. Bonds5

About 2-[2-(phenoxymethyl)phenyl]ethanamine

2-[2-(phenoxymethyl)phenyl]ethanamine (PubChem CID 113314861) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-[2-(phenoxymethyl)phenyl]ethanamine.

Molecular Properties

Compound Name2-[2-(phenoxymethyl)phenyl]ethanamine
PubChem CID113314861
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name2-[2-(phenoxymethyl)phenyl]ethanamine
SMILESNCCc1ccccc1COc1ccccc1
InChIInChI=1S/C15H17NO/c16-11-10-13-6-4-5-7-14(13)12-17-15-8-2-1-3-9-15/h1-9H,10-12,16H2
InChIKeyATKVWVLVVQMVPT-UHFFFAOYSA-N
XLogP2.77
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-[(4-phenylmethoxyphenoxy)methyl]phenyl]ethanamine
CID 113314859
2-[2-(naphthalen-2-yloxymethyl)phenyl]ethanamine
CID 115464887
2-[2-[(4-butylphenoxy)methyl]phenyl]ethanamine
CID 115493361
2-[2-[(3-fluoro-4-methylphenoxy)methyl]phenyl]ethanamine
CID 107170915
2-[2-[(2-methoxyphenoxy)methyl]phenyl]ethanamine
CID 115464876
2-[4-[(2-methylphenyl)methoxy]phenyl]ethanamine
CID 16775885
2-[2-[(2,4-dichlorophenoxy)methyl]phenyl]ethanamine
CID 115464873
2-[2-[(2,3-dimethylphenoxy)methyl]phenyl]ethanamine
CID 115464752
1-(2-methylpropyl)-2-(phenoxymethyl)benzene
CID 173253706
1-(benzenesulfonylmethyl)-2-(phenoxymethyl)benzene
CID 90995304
1-(phenoxymethyl)naphthalene
CID 588110
1-methyl-2-[[2-(phenoxymethyl)phenyl]methoxy]benzene
CID 151703929

Frequently Asked Questions

What is the IUPAC name of 2-[2-(phenoxymethyl)phenyl]ethanamine?
The IUPAC name of 2-[2-(phenoxymethyl)phenyl]ethanamine (CID 113314861) is 2-[2-(phenoxymethyl)phenyl]ethanamine.
What is the SMILES notation for 2-[2-(phenoxymethyl)phenyl]ethanamine?
The canonical SMILES for 2-[2-(phenoxymethyl)phenyl]ethanamine is NCCc1ccccc1COc1ccccc1.
What is the InChIKey of 2-[2-(phenoxymethyl)phenyl]ethanamine?
The InChIKey is ATKVWVLVVQMVPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c16-11-10-13-6-4-5-7-14(13)12-17-15-8-2-1-3-9-15/h1-9H,10-12,16H2.
What are the key properties of 2-[2-(phenoxymethyl)phenyl]ethanamine?
2-[2-(phenoxymethyl)phenyl]ethanamine has a molecular weight of 227.31 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(phenoxymethyl)phenyl]ethanamine is sourced from PubChem (CID 113314861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).