2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone

C19H20FNO2 — CID 110369331

IUPAC2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone
SMILESCC1COC(c2ccccc2)CN1C(=O)Cc1ccc(F)cc1
InChIInChI=1S/C19H20FNO2/c1-14-13-23-18(16-5-3-2-4-6-16)12-21(14)19(22)11-15-7-9-17(20)10-8-15/h2-10,14,18H,11-13H2,1H3
InChIKeyQVSZFJCAZZVHEO-UHFFFAOYSA-N
MW313.37 g/mol
LogP3.36
Rot. Bonds3

About 2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone

2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone (PubChem CID 110369331) has the molecular formula C19H20FNO2 and a molecular weight of 313.37 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone
PubChem CID110369331
Molecular FormulaC19H20FNO2
Molecular Weight313.37 g/mol
Exact Mass313.15
IUPAC Name2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone
SMILESCC1COC(c2ccccc2)CN1C(=O)Cc1ccc(F)cc1
InChIInChI=1S/C19H20FNO2/c1-14-13-23-18(16-5-3-2-4-6-16)12-21(14)19(22)11-15-7-9-17(20)10-8-15/h2-10,14,18H,11-13H2,1H3
InChIKeyQVSZFJCAZZVHEO-UHFFFAOYSA-N
XLogP3.36
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.37
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-fluorophenyl)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]ethanone
CID 81207945
1-[(2R,5R)-5-methyl-2-phenylmorpholin-4-yl]-2-(3-methyl-4-pyridinyl)ethanone
CID 124619460
1-[(2R,5S)-2-(3-chlorophenyl)-5-methylmorpholin-4-yl]-2-pyridin-4-ylethanone
CID 124619075
1-[(2S,5R)-2-(3-chlorophenyl)-5-methylmorpholin-4-yl]-2-pyridin-4-ylethanone
CID 124619076
1-(5-methyl-2-phenylmorpholin-4-yl)-3-piperidin-4-ylbutan-1-one;hydrochloride
CID 119769865
1-(2-methyl-5-phenyl-1,3-oxazolidin-3-yl)-2-phenylethanone
CID 110740541
(4-fluorophenyl)-[5-methyl-2-(4-methylphenyl)morpholin-4-yl]methanone
CID 110369460
2-[4-(aminomethyl)phenyl]-1-(2,5-dimethylmorpholin-4-yl)ethanone
CID 55213909
(4-bromophenyl)-(5-methyl-2-phenylmorpholin-4-yl)methanone
CID 110369319
1-[(2R)-4-acetyl-2-phenylpiperazin-1-yl]-2-(4-fluorophenyl)ethanone
CID 124964959
2-methyl-3-(methylamino)-1-(5-methyl-2-phenylmorpholin-4-yl)propan-1-one
CID 119769860
2-(5-methyl-2-phenylmorpholin-4-yl)acetic acid
CID 119135239

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone?
The IUPAC name of 2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone (CID 110369331) is 2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone.
What is the SMILES notation for 2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone?
The canonical SMILES for 2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone is CC1COC(c2ccccc2)CN1C(=O)Cc1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone?
The InChIKey is QVSZFJCAZZVHEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNO2/c1-14-13-23-18(16-5-3-2-4-6-16)12-21(14)19(22)11-15-7-9-17(20)10-8-15/h2-10,14,18H,11-13H2,1H3.
What are the key properties of 2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone?
2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone has a molecular weight of 313.37 g/mol, XLogP of 3.36, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1-(5-methyl-2-phenylmorpholin-4-yl)ethanone is sourced from PubChem (CID 110369331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).