2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone

C19H19F2NO2 — CID 110369198

IUPAC2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone
SMILESCC1CN(C(=O)Cc2ccc(F)cc2)CC(c2ccc(F)cc2)O1
InChIInChI=1S/C19H19F2NO2/c1-13-11-22(19(23)10-14-2-6-16(20)7-3-14)12-18(24-13)15-4-8-17(21)9-5-15/h2-9,13,18H,10-12H2,1H3
InChIKeyDVEANWNCSVXVRO-UHFFFAOYSA-N
MW331.36 g/mol
LogP3.50
Rot. Bonds3

About 2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone

2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone (PubChem CID 110369198) has the molecular formula C19H19F2NO2 and a molecular weight of 331.36 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone
PubChem CID110369198
Molecular FormulaC19H19F2NO2
Molecular Weight331.36 g/mol
Exact Mass331.14
IUPAC Name2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone
SMILESCC1CN(C(=O)Cc2ccc(F)cc2)CC(c2ccc(F)cc2)O1
InChIInChI=1S/C19H19F2NO2/c1-13-11-22(19(23)10-14-2-6-16(20)7-3-14)12-18(24-13)15-4-8-17(21)9-5-15/h2-9,13,18H,10-12H2,1H3
InChIKeyDVEANWNCSVXVRO-UHFFFAOYSA-N
XLogP3.50
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.36
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-(4-fluorophenyl)ethanone
CID 1121972
1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-(4-fluorophenyl)ethanone
CID 1121974
cyclopropyl-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone
CID 110369168
[5-(aminomethyl)furan-2-yl]-[(2R,6R)-2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone
CID 124694866
1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-pyrrolidin-2-ylethanone;hydrochloride
CID 119799317
(2S)-2-amino-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]propan-1-one
CID 119332587
1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone
CID 110364011
(4-chlorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone
CID 110369215
1,3-benzodioxol-5-yl-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone
CID 110369219
1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-2-methyl-3-(methylamino)propan-1-one;hydrochloride
CID 119799303
(2S)-2-amino-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-3-phenylpropan-1-one;hydrochloride
CID 84588635
[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-[4-(methoxymethyl)piperidin-4-yl]methanone;hydrochloride
CID 120635305

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone?
The IUPAC name of 2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone (CID 110369198) is 2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone.
What is the SMILES notation for 2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone?
The canonical SMILES for 2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone is CC1CN(C(=O)Cc2ccc(F)cc2)CC(c2ccc(F)cc2)O1.
What is the InChIKey of 2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone?
The InChIKey is DVEANWNCSVXVRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F2NO2/c1-13-11-22(19(23)10-14-2-6-16(20)7-3-14)12-18(24-13)15-4-8-17(21)9-5-15/h2-9,13,18H,10-12H2,1H3.
What are the key properties of 2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone?
2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone has a molecular weight of 331.36 g/mol, XLogP of 3.50, 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-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone is sourced from PubChem (CID 110369198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).