(3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone

C17H15F2NO2 — CID 16894709

IUPAC(3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone
SMILESO=C(c1ccc(F)c(F)c1)N1CCOC(c2ccccc2)C1
InChIInChI=1S/C17H15F2NO2/c18-14-7-6-13(10-15(14)19)17(21)20-8-9-22-16(11-20)12-4-2-1-3-5-12/h1-7,10,16H,8-9,11H2
InChIKeyWVHZBEWAPHFTQI-UHFFFAOYSA-N
MW303.31 g/mol
LogP3.18
Rot. Bonds2

About (3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone

(3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone (PubChem CID 16894709) has the molecular formula C17H15F2NO2 and a molecular weight of 303.31 g/mol. Its IUPAC name is (3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone
PubChem CID16894709
Molecular FormulaC17H15F2NO2
Molecular Weight303.31 g/mol
Exact Mass303.11
IUPAC Name(3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone
SMILESO=C(c1ccc(F)c(F)c1)N1CCOC(c2ccccc2)C1
InChIInChI=1S/C17H15F2NO2/c18-14-7-6-13(10-15(14)19)17(21)20-8-9-22-16(11-20)12-4-2-1-3-5-12/h1-7,10,16H,8-9,11H2
InChIKeyWVHZBEWAPHFTQI-UHFFFAOYSA-N
XLogP3.18
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.31
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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1-Benzyl-piperidin-4-yl benzoate
CID 15124790
(2-Hydroxy-2,3-diphenylmorpholin-4-yl)(phenyl)methanone
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2-[Benzyl(methyl)amino]-1-methylethyl 3-fluorobenzoate hydrochloride
CID 15945289
3-(4-{2-[Bis-(4-fluoro-phenyl)-methoxy]-ethyl}-piperazin-1-yl)-1-(3-fluoro-phenyl)-propan-1-one
CID 44278382
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Frequently Asked Questions

What is the IUPAC name of (3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone?
The IUPAC name of (3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone (CID 16894709) is (3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone.
What is the SMILES notation for (3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone?
The canonical SMILES for (3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone is O=C(c1ccc(F)c(F)c1)N1CCOC(c2ccccc2)C1.
What is the InChIKey of (3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone?
The InChIKey is WVHZBEWAPHFTQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F2NO2/c18-14-7-6-13(10-15(14)19)17(21)20-8-9-22-16(11-20)12-4-2-1-3-5-12/h1-7,10,16H,8-9,11H2.
What are the key properties of (3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone?
(3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone has a molecular weight of 303.31 g/mol, XLogP of 3.18, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-difluorophenyl)-(2-phenylmorpholin-4-yl)methanone is sourced from PubChem (CID 16894709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).