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

C20H23NO2 — CID 12805102

IUPAC[3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone
SMILESCC(CN1CCOCC1)c1cccc(C(=O)c2ccccc2)c1
InChIInChI=1S/C20H23NO2/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
InChIKeyIGLLJOWMVVYQEN-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.35
Rot. Bonds5

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

[3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone (PubChem CID 12805102) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone.

Molecular Properties

Compound Name[3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone
PubChem CID12805102
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Name[3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone
SMILESCC(CN1CCOCC1)c1cccc(C(=O)c2ccccc2)c1
InChIInChI=1S/C20H23NO2/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
InChIKeyIGLLJOWMVVYQEN-UHFFFAOYSA-N
XLogP3.35
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone?
The IUPAC name of [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone (CID 12805102) is [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone.
What is the SMILES notation for [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone?
The canonical SMILES for [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone is CC(CN1CCOCC1)c1cccc(C(=O)c2ccccc2)c1.
What is the InChIKey of [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone?
The InChIKey is IGLLJOWMVVYQEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/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.
What are the key properties of [3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone?
[3-(1-morpholin-4-ylpropan-2-yl)phenyl]-phenylmethanone has a molecular weight of 309.41 g/mol, XLogP of 3.35, 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 is sourced from PubChem (CID 12805102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).