2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine

C17H18FNO — CID 115996210

IUPAC2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine
SMILESCC1NC(c2ccccc2)COC1c1ccccc1F
InChIInChI=1S/C17H18FNO/c1-12-17(14-9-5-6-10-15(14)18)20-11-16(19-12)13-7-3-2-4-8-13/h2-10,12,16-17,19H,11H2,1H3
InChIKeyZBGBZVKBQIDEDN-UHFFFAOYSA-N
MW271.34 g/mol
LogP3.62
Rot. Bonds2

About 2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine

2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine (PubChem CID 115996210) has the molecular formula C17H18FNO and a molecular weight of 271.34 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine.

Molecular Properties

Compound Name2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine
PubChem CID115996210
Molecular FormulaC17H18FNO
Molecular Weight271.34 g/mol
Exact Mass271.14
IUPAC Name2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine
SMILESCC1NC(c2ccccc2)COC1c1ccccc1F
InChIInChI=1S/C17H18FNO/c1-12-17(14-9-5-6-10-15(14)18)20-11-16(19-12)13-7-3-2-4-8-13/h2-10,12,16-17,19H,11H2,1H3
InChIKeyZBGBZVKBQIDEDN-UHFFFAOYSA-N
XLogP3.62
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S,4aS,7S,8aS)-3,7-diphenyl-2,3,4,4a,6,7,8,8a-octahydro-[1,4]oxazino[3,2-b][1,4]oxazine
CID 102169361
2-(2-fluorophenyl)-4-methylazetidine
CID 116822055
(2R,3R,5S)-2-(2-fluorophenyl)-3,4,5-trimethylmorpholine
CID 54517292
4-fluoro-1-methyl-3,4-dihydro-1H-isochromene
CID 175402558
(5S)-3,5-dimethyl-2-(2,4,5-trifluorophenyl)morpholine;hydrochloride
CID 67655985
bis(4-phenyl-1,3-oxazolidin-2-yl)methanone
CID 174878189
(3R,5R)-3-methyl-5-phenylmorpholin-2-one
CID 15042724
(2R,3S)-3-(2-fluorophenyl)-2-methyl-1,4-dioxaspiro[4.5]decane
CID 150430231
(2R,3R,5R)-3-(3-methylbut-2-enyl)-5-phenylmorpholin-2-ol
CID 11139455
[(2R,3S,4R,6R)-4-(3-fluoro-2-methylphenyl)-2,6-dimethylpiperidin-3-yl]-phenylmethanone
CID 173119823
(2S,4S,5R)-2-(4-fluorophenyl)-4-methyl-5-phenyl-1,3-oxazolidine
CID 10796683
2-(4-chlorophenyl)-3,5-dimethylmorpholine
CID 43367104

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine?
The IUPAC name of 2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine (CID 115996210) is 2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine.
What is the SMILES notation for 2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine?
The canonical SMILES for 2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine is CC1NC(c2ccccc2)COC1c1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine?
The InChIKey is ZBGBZVKBQIDEDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO/c1-12-17(14-9-5-6-10-15(14)18)20-11-16(19-12)13-7-3-2-4-8-13/h2-10,12,16-17,19H,11H2,1H3.
What are the key properties of 2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine?
2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine has a molecular weight of 271.34 g/mol, XLogP of 3.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine is sourced from PubChem (CID 115996210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).