1-(4-phenoxy-3-phenylphenyl)ethanamine

C20H19NO — CID 154960634

IUPAC1-(4-phenoxy-3-phenylphenyl)ethanamine
SMILESCC(N)c1ccc(Oc2ccccc2)c(-c2ccccc2)c1
InChIInChI=1S/C20H19NO/c1-15(21)17-12-13-20(22-18-10-6-3-7-11-18)19(14-17)16-8-4-2-5-9-16/h2-15H,21H2,1H3
InChIKeyMTVPSTLAHWYCBX-UHFFFAOYSA-N
MW289.38 g/mol
LogP5.17
Rot. Bonds4

About 1-(4-phenoxy-3-phenylphenyl)ethanamine

1-(4-phenoxy-3-phenylphenyl)ethanamine (PubChem CID 154960634) has the molecular formula C20H19NO and a molecular weight of 289.38 g/mol. Its IUPAC name is 1-(4-phenoxy-3-phenylphenyl)ethanamine.

Molecular Properties

Compound Name1-(4-phenoxy-3-phenylphenyl)ethanamine
PubChem CID154960634
Molecular FormulaC20H19NO
Molecular Weight289.38 g/mol
Exact Mass289.15
IUPAC Name1-(4-phenoxy-3-phenylphenyl)ethanamine
SMILESCC(N)c1ccc(Oc2ccccc2)c(-c2ccccc2)c1
InChIInChI=1S/C20H19NO/c1-15(21)17-12-13-20(22-18-10-6-3-7-11-18)19(14-17)16-8-4-2-5-9-16/h2-15H,21H2,1H3
InChIKeyMTVPSTLAHWYCBX-UHFFFAOYSA-N
XLogP5.17
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500289.38
LogP ≤ 55.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-bis(4-methylphenoxy)-2-phenylbenzene;ethane
CID 144542678
(1S)-1-(3,4-diphenoxyphenyl)propan-1-amine
CID 171217949
1-(4-methoxy-3-phenylphenyl)ethanol
CID 117328991
(3R)-3-amino-3-(3,4-diphenoxyphenyl)propan-1-ol
CID 171198479
(4R)-4-amino-4-(3,4-diphenoxyphenyl)butan-1-ol;hydrochloride
CID 171198482
(1R)-1-(3,4-diphenoxyphenyl)-3-methylbutan-1-amine;hydrochloride
CID 171198444
4-(4-phenoxy-3-phenylphenyl)benzene-1,3-diamine
CID 176653688
(1S)-1-(3,4-diphenoxyphenyl)-3-methylbutan-1-amine;hydrochloride
CID 171217962
1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene
CID 54513484
1-(4-ethenylphenoxy)-4-[(4-ethenylphenyl)-hydroperoxymethyl]-2-phenylbenzene
CID 118667760
(1R)-1-[3-bromo-4-(3-methoxyphenoxy)phenyl]ethanamine
CID 78937846
1-[3-fluoro-4-(3-methylphenoxy)phenyl]ethanamine
CID 43189188

Frequently Asked Questions

What is the IUPAC name of 1-(4-phenoxy-3-phenylphenyl)ethanamine?
The IUPAC name of 1-(4-phenoxy-3-phenylphenyl)ethanamine (CID 154960634) is 1-(4-phenoxy-3-phenylphenyl)ethanamine.
What is the SMILES notation for 1-(4-phenoxy-3-phenylphenyl)ethanamine?
The canonical SMILES for 1-(4-phenoxy-3-phenylphenyl)ethanamine is CC(N)c1ccc(Oc2ccccc2)c(-c2ccccc2)c1.
What is the InChIKey of 1-(4-phenoxy-3-phenylphenyl)ethanamine?
The InChIKey is MTVPSTLAHWYCBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO/c1-15(21)17-12-13-20(22-18-10-6-3-7-11-18)19(14-17)16-8-4-2-5-9-16/h2-15H,21H2,1H3.
What are the key properties of 1-(4-phenoxy-3-phenylphenyl)ethanamine?
1-(4-phenoxy-3-phenylphenyl)ethanamine has a molecular weight of 289.38 g/mol, XLogP of 5.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-phenoxy-3-phenylphenyl)ethanamine is sourced from PubChem (CID 154960634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).