1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone

C19H21NO3 — CID 644374

IUPAC1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone
SMILESCOc1ccc(C(=O)C(c2ccccc2)N2CCOCC2)cc1
InChIInChI=1S/C19H21NO3/c1-22-17-9-7-16(8-10-17)19(21)18(15-5-3-2-4-6-15)20-11-13-23-14-12-20/h2-10,18H,11-14H2,1H3
InChIKeyQMFVJCSHYOSQRY-UHFFFAOYSA-N
MW311.38 g/mol
LogP2.95
Rot. Bonds5

About 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone

1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone (PubChem CID 644374) has the molecular formula C19H21NO3 and a molecular weight of 311.38 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone
PubChem CID644374
Molecular FormulaC19H21NO3
Molecular Weight311.38 g/mol
Exact Mass311.15
IUPAC Name1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone
SMILESCOc1ccc(C(=O)C(c2ccccc2)N2CCOCC2)cc1
InChIInChI=1S/C19H21NO3/c1-22-17-9-7-16(8-10-17)19(21)18(15-5-3-2-4-6-15)20-11-13-23-14-12-20/h2-10,18H,11-14H2,1H3
InChIKeyQMFVJCSHYOSQRY-UHFFFAOYSA-N
XLogP2.95
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-[(Z)-[(1S)-1-morpholin-4-yl-1-phenylpropan-2-ylidene]amino]benzamide
CID 9231603
1-(4-chlorophenyl)-2-morpholin-4-yl-2-phenylethanone
CID 71319479
(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylacetamide
CID 92642329
2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-1,2-diphenylethanone
CID 12505294
1-(4-chlorophenyl)-2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-2-phenylethanone
CID 12505299
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride
CID 18530910
(2-morpholin-4-yl-2-oxo-1-phenylethyl) 4-methoxybenzoate
CID 18198778
(2R,3R)-2,3-dimorpholin-4-yl-1-(4-phenoxyphenyl)-3-phenylpropan-1-one
CID 92573674
(2S)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-yl]-1-morpholin-4-yl-2-phenylethanone
CID 30624445
1,2-dimorpholin-4-yl-2-phenylethanone
CID 657415
N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2,2-diphenylacetamide
CID 2467575
3-(4-methoxyphenyl)-3-morpholin-4-ylpropanoic acid
CID 64527154

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone?
The IUPAC name of 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone (CID 644374) is 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone.
What is the SMILES notation for 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone?
The canonical SMILES for 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone is COc1ccc(C(=O)C(c2ccccc2)N2CCOCC2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone?
The InChIKey is QMFVJCSHYOSQRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO3/c1-22-17-9-7-16(8-10-17)19(21)18(15-5-3-2-4-6-15)20-11-13-23-14-12-20/h2-10,18H,11-14H2,1H3.
What are the key properties of 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone?
1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone has a molecular weight of 311.38 g/mol, XLogP of 2.95, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone is sourced from PubChem (CID 644374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).