[3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride

C20H24ClNO2 — CID 12805103

IUPAC[3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride
SMILESCC(CN1CCOCC1)c1cccc(C(=O)c2ccccc2)c1.Cl
InChIInChI=1S/C20H23NO2.ClH/c1-16(15-21-10-12-23-13-11-21)18-8-5-9-19(14-18)20(22)17-6-3-2-4-7-17;/h2-9,14,16H,10-13,15H2,1H3;1H
InChIKeyOQMOCQQOYZBNSP-UHFFFAOYSA-N
MW345.87 g/mol
LogP3.78
Rot. Bonds5

About [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride

[3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride (PubChem CID 12805103) has the molecular formula C20H24ClNO2 and a molecular weight of 345.87 g/mol. Its IUPAC name is [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride.

Molecular Properties

Compound Name[3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride
PubChem CID12805103
Molecular FormulaC20H24ClNO2
Molecular Weight345.87 g/mol
Exact Mass345.15
IUPAC Name[3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride
SMILESCC(CN1CCOCC1)c1cccc(C(=O)c2ccccc2)c1.Cl
InChIInChI=1S/C20H23NO2.ClH/c1-16(15-21-10-12-23-13-11-21)18-8-5-9-19(14-18)20(22)17-6-3-2-4-7-17;/h2-9,14,16H,10-13,15H2,1H3;1H
InChIKeyOQMOCQQOYZBNSP-UHFFFAOYSA-N
XLogP3.78
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.87
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride 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 [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride?
The IUPAC name of [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride (CID 12805103) is [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride.
What is the SMILES notation for [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride?
The canonical SMILES for [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride is CC(CN1CCOCC1)c1cccc(C(=O)c2ccccc2)c1.Cl.
What is the InChIKey of [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride?
The InChIKey is OQMOCQQOYZBNSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2.ClH/c1-16(15-21-10-12-23-13-11-21)18-8-5-9-19(14-18)20(22)17-6-3-2-4-7-17;/h2-9,14,16H,10-13,15H2,1H3;1H.
What are the key properties of [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride?
[3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride has a molecular weight of 345.87 g/mol, XLogP of 3.78, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone;hydrochloride is sourced from PubChem (CID 12805103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).