(4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone

C19H21NO3 — CID 110369323

IUPAC(4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone
SMILESCOc1ccc(C(=O)N2CC(c3ccccc3)OCC2C)cc1
InChIInChI=1S/C19H21NO3/c1-14-13-23-18(15-6-4-3-5-7-15)12-20(14)19(21)16-8-10-17(22-2)11-9-16/h3-11,14,18H,12-13H2,1-2H3
InChIKeyXMWQSNXCSLTRGT-UHFFFAOYSA-N
MW311.38 g/mol
LogP3.30
Rot. Bonds3

About (4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone

(4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone (PubChem CID 110369323) has the molecular formula C19H21NO3 and a molecular weight of 311.38 g/mol. Its IUPAC name is (4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone
PubChem CID110369323
Molecular FormulaC19H21NO3
Molecular Weight311.38 g/mol
Exact Mass311.15
IUPAC Name(4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone
SMILESCOc1ccc(C(=O)N2CC(c3ccccc3)OCC2C)cc1
InChIInChI=1S/C19H21NO3/c1-14-13-23-18(15-6-4-3-5-7-15)12-20(14)19(21)16-8-10-17(22-2)11-9-16/h3-11,14,18H,12-13H2,1-2H3
InChIKeyXMWQSNXCSLTRGT-UHFFFAOYSA-N
XLogP3.30
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 ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3,5-dimethoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone
CID 110369324
(4-bromophenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone
CID 110369319
(4-methoxyphenyl)-(2-methyl-5-phenyl-1,3-oxazolidin-3-yl)methanone
CID 110740536
1,3-benzodioxol-5-yl-[2-(4-methoxyphenyl)-5-methylmorpholin-4-yl]methanone
CID 110369613
(4-methoxyphenyl)-(2-methylaziridin-1-yl)methanone
CID 11194838
5-[(2S,5S)-5-methyl-2-phenylmorpholine-4-carbonyl]pyridine-2-carboxylic acid
CID 124696561
2-ethyl-1-[2-(4-methoxyphenyl)-5-methylmorpholin-4-yl]butan-1-one
CID 110369570
(4-methoxyphenyl)-(3-methyl-2-phenylmorpholin-4-yl)methanone
CID 110728442
(4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone
CID 110369460
1-adamantyl-[2-(4-methoxyphenyl)-5-methylmorpholin-4-yl]methanone
CID 110369629
[(2S,5R)-5-methyl-2-phenylmorpholin-4-yl]-[(2R)-oxolan-2-yl]methanone
CID 124711560
2-[4-[(2S,5R)-5-methyl-2-phenylmorpholine-4-carbonyl]triazol-1-yl]acetic acid
CID 166303132

Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone?
The IUPAC name of (4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone (CID 110369323) is (4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone.
What is the SMILES notation for (4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone?
The canonical SMILES for (4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone is COc1ccc(C(=O)N2CC(c3ccccc3)OCC2C)cc1.
What is the InChIKey of (4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone?
The InChIKey is XMWQSNXCSLTRGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO3/c1-14-13-23-18(15-6-4-3-5-7-15)12-20(14)19(21)16-8-10-17(22-2)11-9-16/h3-11,14,18H,12-13H2,1-2H3.
What are the key properties of (4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone?
(4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone has a molecular weight of 311.38 g/mol, XLogP of 3.30, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone is sourced from PubChem (CID 110369323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).