(2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone

C19H21NO4 — CID 84544929

IUPAC(2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone
SMILESCOc1ccc(OC)c(C(=O)N2CCOC(c3ccccc3)C2)c1
InChIInChI=1S/C19H21NO4/c1-22-15-8-9-17(23-2)16(12-15)19(21)20-10-11-24-18(13-20)14-6-4-3-5-7-14/h3-9,12,18H,10-11,13H2,1-2H3
InChIKeyCVIPCDWHUYQLNJ-UHFFFAOYSA-N
MW327.38 g/mol
LogP2.92
Rot. Bonds4

About (2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone

(2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone (PubChem CID 84544929) has the molecular formula C19H21NO4 and a molecular weight of 327.38 g/mol. Its IUPAC name is (2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone
PubChem CID84544929
Molecular FormulaC19H21NO4
Molecular Weight327.38 g/mol
Exact Mass327.15
IUPAC Name(2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone
SMILESCOc1ccc(OC)c(C(=O)N2CCOC(c3ccccc3)C2)c1
InChIInChI=1S/C19H21NO4/c1-22-15-8-9-17(23-2)16(12-15)19(21)20-10-11-24-18(13-20)14-6-4-3-5-7-14/h3-9,12,18H,10-11,13H2,1-2H3
InChIKeyCVIPCDWHUYQLNJ-UHFFFAOYSA-N
XLogP2.92
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(3,4-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone
CID 16894714
(2-methoxyphenyl)-[2-(4-methylphenyl)morpholin-4-yl]methanone
CID 110326509
(2-fluorophenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone
CID 110327171
N-(2-methoxy-5-methylphenyl)-2-phenylmorpholine-4-carboxamide
CID 84526391
(3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone
CID 110327180
5-methoxy-2-(2-phenylmorpholine-4-carbonyl)-1H-pyridin-4-one
CID 128963323
2-(4-methoxyphenoxy)-1-[(2S)-2-phenylmorpholin-4-yl]ethanone
CID 25281339
2-(4-methoxyphenoxy)-1-[(2R)-2-phenylmorpholin-4-yl]ethanone
CID 25281342
(4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone
CID 95203094
[(2R)-2-[4-(trifluoromethyl)phenyl]morpholin-4-yl]-(2,4,5-trimethoxyphenyl)methanone
CID 97350041
2,5-dimethoxy-N-[4-oxo-4-(2-phenylmorpholin-4-yl)butyl]benzenesulfonamide
CID 16895157
(2,5-dimethoxyphenyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 66262175

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone?
The IUPAC name of (2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone (CID 84544929) is (2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone.
What is the SMILES notation for (2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone?
The canonical SMILES for (2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone is COc1ccc(OC)c(C(=O)N2CCOC(c3ccccc3)C2)c1.
What is the InChIKey of (2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone?
The InChIKey is CVIPCDWHUYQLNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO4/c1-22-15-8-9-17(23-2)16(12-15)19(21)20-10-11-24-18(13-20)14-6-4-3-5-7-14/h3-9,12,18H,10-11,13H2,1-2H3.
What are the key properties of (2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone?
(2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone has a molecular weight of 327.38 g/mol, XLogP of 2.92, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone is sourced from PubChem (CID 84544929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).