(2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone

C19H21NO3 — CID 2874589

IUPAC(2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone
SMILESCC1CN(C(=O)c2ccccc2Oc2ccccc2)CC(C)O1
InChIInChI=1S/C19H21NO3/c1-14-12-20(13-15(2)22-14)19(21)17-10-6-7-11-18(17)23-16-8-4-3-5-9-16/h3-11,14-15H,12-13H2,1-2H3
InChIKeyIMXXRDJKUAZOLN-UHFFFAOYSA-N
MW311.38 g/mol
LogP3.73
Rot. Bonds3

About (2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone

(2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone (PubChem CID 2874589) has the molecular formula C19H21NO3 and a molecular weight of 311.38 g/mol. Its IUPAC name is (2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone.

Molecular Properties

Compound Name(2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone
PubChem CID2874589
Molecular FormulaC19H21NO3
Molecular Weight311.38 g/mol
Exact Mass311.15
IUPAC Name(2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone
SMILESCC1CN(C(=O)c2ccccc2Oc2ccccc2)CC(C)O1
InChIInChI=1S/C19H21NO3/c1-14-12-20(13-15(2)22-14)19(21)17-10-6-7-11-18(17)23-16-8-4-3-5-9-16/h3-11,14-15H,12-13H2,1-2H3
InChIKeyIMXXRDJKUAZOLN-UHFFFAOYSA-N
XLogP3.73
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone?
The IUPAC name of (2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone (CID 2874589) is (2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone.
What is the SMILES notation for (2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone?
The canonical SMILES for (2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone is CC1CN(C(=O)c2ccccc2Oc2ccccc2)CC(C)O1.
What is the InChIKey of (2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone?
The InChIKey is IMXXRDJKUAZOLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO3/c1-14-12-20(13-15(2)22-14)19(21)17-10-6-7-11-18(17)23-16-8-4-3-5-9-16/h3-11,14-15H,12-13H2,1-2H3.
What are the key properties of (2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone?
(2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone has a molecular weight of 311.38 g/mol, XLogP of 3.73, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylmorpholin-4-yl)-(2-phenoxyphenyl)methanone is sourced from PubChem (CID 2874589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).