1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone

C20H23NO2 — CID 2961161

IUPAC1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone
SMILESCC1CN(C(=O)Cc2ccc(-c3ccccc3)cc2)CC(C)O1
InChIInChI=1S/C20H23NO2/c1-15-13-21(14-16(2)23-15)20(22)12-17-8-10-19(11-9-17)18-6-4-3-5-7-18/h3-11,15-16H,12-14H2,1-2H3
InChIKeyFMMGDKQSWFYCPM-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.53
Rot. Bonds3

About 1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone

1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone (PubChem CID 2961161) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is 1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone.

Molecular Properties

Compound Name1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone
PubChem CID2961161
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Name1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone
SMILESCC1CN(C(=O)Cc2ccc(-c3ccccc3)cc2)CC(C)O1
InChIInChI=1S/C20H23NO2/c1-15-13-21(14-16(2)23-15)20(22)12-17-8-10-19(11-9-17)18-6-4-3-5-7-18/h3-11,15-16H,12-14H2,1-2H3
InChIKeyFMMGDKQSWFYCPM-UHFFFAOYSA-N
XLogP3.53
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone?
The IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone (CID 2961161) is 1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone.
What is the SMILES notation for 1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone?
The canonical SMILES for 1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone is CC1CN(C(=O)Cc2ccc(-c3ccccc3)cc2)CC(C)O1.
What is the InChIKey of 1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone?
The InChIKey is FMMGDKQSWFYCPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/c1-15-13-21(14-16(2)23-15)20(22)12-17-8-10-19(11-9-17)18-6-4-3-5-7-18/h3-11,15-16H,12-14H2,1-2H3.
What are the key properties of 1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone?
1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone has a molecular weight of 309.41 g/mol, XLogP of 3.53, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylphenyl)ethanone is sourced from PubChem (CID 2961161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).