1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone

C20H25NO2 — CID 10380767

IUPAC1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone
SMILESCCN(CC)CCOc1ccccc1C(=O)Cc1ccccc1
InChIInChI=1S/C20H25NO2/c1-3-21(4-2)14-15-23-20-13-9-8-12-18(20)19(22)16-17-10-6-5-7-11-17/h5-13H,3-4,14-16H2,1-2H3
InChIKeyUXJIAYWWVGVCIV-UHFFFAOYSA-N
MW311.43 g/mol
LogP3.83
Rot. Bonds9

About 1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone

1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone (PubChem CID 10380767) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is 1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone.

Molecular Properties

Compound Name1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone
PubChem CID10380767
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC Name1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone
SMILESCCN(CC)CCOc1ccccc1C(=O)Cc1ccccc1
InChIInChI=1S/C20H25NO2/c1-3-21(4-2)14-15-23-20-13-9-8-12-18(20)19(22)16-17-10-6-5-7-11-17/h5-13H,3-4,14-16H2,1-2H3
InChIKeyUXJIAYWWVGVCIV-UHFFFAOYSA-N
XLogP3.83
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone?
The IUPAC name of 1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone (CID 10380767) is 1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone.
What is the SMILES notation for 1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone?
The canonical SMILES for 1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone is CCN(CC)CCOc1ccccc1C(=O)Cc1ccccc1.
What is the InChIKey of 1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone?
The InChIKey is UXJIAYWWVGVCIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2/c1-3-21(4-2)14-15-23-20-13-9-8-12-18(20)19(22)16-17-10-6-5-7-11-17/h5-13H,3-4,14-16H2,1-2H3.
What are the key properties of 1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone?
1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone has a molecular weight of 311.43 g/mol, XLogP of 3.83, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(diethylamino)ethoxy]phenyl]-2-phenylethanone is sourced from PubChem (CID 10380767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).