4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one

C20H23NO3 — CID 122194666

IUPAC4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one
SMILESO=C(CC(CO)c1ccc(-c2ccccc2)cc1)N1CCOCC1
InChIInChI=1S/C20H23NO3/c22-15-19(14-20(23)21-10-12-24-13-11-21)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19,22H,10-15H2
InChIKeyQMUFNFMFPXKIMN-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.68
Rot. Bonds5

About 4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one

4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one (PubChem CID 122194666) has the molecular formula C20H23NO3 and a molecular weight of 325.41 g/mol. Its IUPAC name is 4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one.

Molecular Properties

Compound Name4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one
PubChem CID122194666
Molecular FormulaC20H23NO3
Molecular Weight325.41 g/mol
Exact Mass325.17
IUPAC Name4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one
SMILESO=C(CC(CO)c1ccc(-c2ccccc2)cc1)N1CCOCC1
InChIInChI=1S/C20H23NO3/c22-15-19(14-20(23)21-10-12-24-13-11-21)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19,22H,10-15H2
InChIKeyQMUFNFMFPXKIMN-UHFFFAOYSA-N
XLogP2.68
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Morpholino-2,2-diphenylethanone
CID 229280
4-(4-Biphenylylacetyl)morpholine
CID 2265867
[4-(1-Diphenylacetyl-piperidin-4-ylidenemethyl)-phenyl]-acetic acid
CID 11122765
Lansamide 4
CID 10519101
Lansamide 3
CID 10685418
3-Hydroxy-1-(morpholin-4-yl)-2,3-diphenylpropan-1-one
CID 236250
3-(4-Isopropylphenyl)-1-morpholinopropan-1-one
CID 16725066
1-Butanol, 2,2-diphenyl-4-morpholino-
CID 48217
Acetic acid, diphenyl-, 2-piperidinoethyl ester, hydrochloride
CID 199017
4-Morpholinepropanamide, alpha-(2-hydroxy-1-phenylethyl)-
CID 3062956
3-(Morpholine-4-carbonyl)-2,4-diphenyl-cyclobutanecarboxylic acid
CID 650620
[4-(2-phenylethyl)-1-(tetrahydro-2H-pyran-4-ylcarbonyl)piperidin-4-yl]methanol
CID 16188733

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one?
The IUPAC name of 4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one (CID 122194666) is 4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one.
What is the SMILES notation for 4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one?
The canonical SMILES for 4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one is O=C(CC(CO)c1ccc(-c2ccccc2)cc1)N1CCOCC1.
What is the InChIKey of 4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one?
The InChIKey is QMUFNFMFPXKIMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO3/c22-15-19(14-20(23)21-10-12-24-13-11-21)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-9,19,22H,10-15H2.
What are the key properties of 4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one?
4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one has a molecular weight of 325.41 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-morpholin-4-yl-3-(4-phenylphenyl)butan-1-one is sourced from PubChem (CID 122194666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).