[2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone

C23H23NO — CID 150978670

IUPAC[2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone
SMILESCCN(CC)c1ccccc1-c1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C23H23NO/c1-3-24(4-2)22-17-11-10-15-20(22)19-14-8-9-16-21(19)23(25)18-12-6-5-7-13-18/h5-17H,3-4H2,1-2H3
InChIKeyLPQDCRFNJLBPHX-UHFFFAOYSA-N
MW329.44 g/mol
LogP5.43
Rot. Bonds6

About [2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone

[2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone (PubChem CID 150978670) has the molecular formula C23H23NO and a molecular weight of 329.44 g/mol. Its IUPAC name is [2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone.

Molecular Properties

Compound Name[2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone
PubChem CID150978670
Molecular FormulaC23H23NO
Molecular Weight329.44 g/mol
Exact Mass329.18
IUPAC Name[2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone
SMILESCCN(CC)c1ccccc1-c1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C23H23NO/c1-3-24(4-2)22-17-11-10-15-20(22)19-14-8-9-16-21(19)23(25)18-12-6-5-7-13-18/h5-17H,3-4H2,1-2H3
InChIKeyLPQDCRFNJLBPHX-UHFFFAOYSA-N
XLogP5.43
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.44
LogP ≤ 55.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone?
The IUPAC name of [2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone (CID 150978670) is [2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone.
What is the SMILES notation for [2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone?
The canonical SMILES for [2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone is CCN(CC)c1ccccc1-c1ccccc1C(=O)c1ccccc1.
What is the InChIKey of [2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone?
The InChIKey is LPQDCRFNJLBPHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO/c1-3-24(4-2)22-17-11-10-15-20(22)19-14-8-9-16-21(19)23(25)18-12-6-5-7-13-18/h5-17H,3-4H2,1-2H3.
What are the key properties of [2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone?
[2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone has a molecular weight of 329.44 g/mol, XLogP of 5.43, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(diethylamino)phenyl]phenyl]-phenylmethanone is sourced from PubChem (CID 150978670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).