(2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone

C18H16ClF2NO2 — CID 110369220

IUPAC(2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone
SMILESCC1CN(C(=O)c2c(F)cccc2Cl)CC(c2ccc(F)cc2)O1
InChIInChI=1S/C18H16ClF2NO2/c1-11-9-22(18(23)17-14(19)3-2-4-15(17)21)10-16(24-11)12-5-7-13(20)8-6-12/h2-8,11,16H,9-10H2,1H3
InChIKeyWJBJKSNBPHCQLA-UHFFFAOYSA-N
MW351.78 g/mol
LogP4.22
Rot. Bonds2

About (2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone

(2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone (PubChem CID 110369220) has the molecular formula C18H16ClF2NO2 and a molecular weight of 351.78 g/mol. Its IUPAC name is (2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone.

Molecular Properties

Compound Name(2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone
PubChem CID110369220
Molecular FormulaC18H16ClF2NO2
Molecular Weight351.78 g/mol
Exact Mass351.08
IUPAC Name(2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone
SMILESCC1CN(C(=O)c2c(F)cccc2Cl)CC(c2ccc(F)cc2)O1
InChIInChI=1S/C18H16ClF2NO2/c1-11-9-22(18(23)17-14(19)3-2-4-15(17)21)10-16(24-11)12-5-7-13(20)8-6-12/h2-8,11,16H,9-10H2,1H3
InChIKeyWJBJKSNBPHCQLA-UHFFFAOYSA-N
XLogP4.22
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.78
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4-chlorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone
CID 110369215
(2-chloro-6-fluorophenyl)-(2-methylmorpholin-4-yl)methanone
CID 52985815
cyclopropyl-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone
CID 110369168
(2-chloro-6-fluorophenyl)-(3-methylpyrrolidin-1-yl)methanone
CID 110749738
(2S)-2-amino-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]propan-1-one
CID 119332587
2-(4-fluorophenyl)-1-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]ethanone
CID 110369198
1,3-benzodioxol-5-yl-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone
CID 110369219
(5-amino-2-methylphenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone
CID 120635302
(2-bromo-4-fluorophenyl)-(2-methyl-6-phenylmorpholin-4-yl)methanone
CID 47914309
[5-(aminomethyl)furan-2-yl]-[(2R,6R)-2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone
CID 124694866
(2-chloro-6-fluorophenyl)-(3-methylpiperidin-1-yl)methanone
CID 17217403
(2-chlorophenyl)-(2,6-dimethylmorpholin-4-yl)methanone
CID 3516702

Frequently Asked Questions

What is the IUPAC name of (2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone?
The IUPAC name of (2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone (CID 110369220) is (2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone.
What is the SMILES notation for (2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone?
The canonical SMILES for (2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone is CC1CN(C(=O)c2c(F)cccc2Cl)CC(c2ccc(F)cc2)O1.
What is the InChIKey of (2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone?
The InChIKey is WJBJKSNBPHCQLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16ClF2NO2/c1-11-9-22(18(23)17-14(19)3-2-4-15(17)21)10-16(24-11)12-5-7-13(20)8-6-12/h2-8,11,16H,9-10H2,1H3.
What are the key properties of (2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone?
(2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone has a molecular weight of 351.78 g/mol, XLogP of 4.22, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-6-fluorophenyl)-[2-(4-fluorophenyl)-6-methylmorpholin-4-yl]methanone is sourced from PubChem (CID 110369220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).