[4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone

C17H19NO2 — CID 11086807

IUPAC[4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone
SMILESCN(C)CCOc1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C17H19NO2/c1-18(2)12-13-20-16-10-8-15(9-11-16)17(19)14-6-4-3-5-7-14/h3-11H,12-13H2,1-2H3
InChIKeyYVDXPPVFFOUDJK-UHFFFAOYSA-N
MW269.34 g/mol
LogP2.86
Rot. Bonds6

About [4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone

[4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone (PubChem CID 11086807) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is [4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone.

Molecular Properties

Compound Name[4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone
PubChem CID11086807
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name[4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone
SMILESCN(C)CCOc1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C17H19NO2/c1-18(2)12-13-20-16-10-8-15(9-11-16)17(19)14-6-4-3-5-7-14/h3-11H,12-13H2,1-2H3
InChIKeyYVDXPPVFFOUDJK-UHFFFAOYSA-N
XLogP2.86
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze [4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone?
The IUPAC name of [4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone (CID 11086807) is [4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone.
What is the SMILES notation for [4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone?
The canonical SMILES for [4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone is CN(C)CCOc1ccc(C(=O)c2ccccc2)cc1.
What is the InChIKey of [4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone?
The InChIKey is YVDXPPVFFOUDJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-18(2)12-13-20-16-10-8-15(9-11-16)17(19)14-6-4-3-5-7-14/h3-11H,12-13H2,1-2H3.
What are the key properties of [4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone?
[4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone has a molecular weight of 269.34 g/mol, XLogP of 2.86, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(dimethylamino)ethoxy]phenyl]-phenylmethanone is sourced from PubChem (CID 11086807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).