2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone

C14H17ClFNO2 — CID 17381748

IUPAC2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)Cc2c(F)cccc2Cl)CC(C)O1
InChIInChI=1S/C14H17ClFNO2/c1-9-7-17(8-10(2)19-9)14(18)6-11-12(15)4-3-5-13(11)16/h3-5,9-10H,6-8H2,1-2H3
InChIKeyOBZUZHKAVRXCRM-UHFFFAOYSA-N
MW285.75 g/mol
LogP2.66
Rot. Bonds2

About 2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone

2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone (PubChem CID 17381748) has the molecular formula C14H17ClFNO2 and a molecular weight of 285.75 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone
PubChem CID17381748
Molecular FormulaC14H17ClFNO2
Molecular Weight285.75 g/mol
Exact Mass285.09
IUPAC Name2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)Cc2c(F)cccc2Cl)CC(C)O1
InChIInChI=1S/C14H17ClFNO2/c1-9-7-17(8-10(2)19-9)14(18)6-11-12(15)4-3-5-13(11)16/h3-5,9-10H,6-8H2,1-2H3
InChIKeyOBZUZHKAVRXCRM-UHFFFAOYSA-N
XLogP2.66
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.75
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Chloro-1-(morpholin-4-yl)-2-phenylethan-1-one
CID 4962514
4-(2-Chlorobenzoyl)-morpholine
CID 225451
2-(4-Chlorophenyl)-1-(4-morpholinyl)ethanone
CID 1124089
2-(2-Chlorophenyl)-1-morpholin-4-ylethanone
CID 1245975
Cb-813
CID 208688
2-(2-chloro-6-fluorophenyl)-N-(2-morpholin-4-ylethyl)acetamide
CID 1094119
[2-(3-Methylpiperidin-1-yl)-2-oxoethyl] 2-(2-chloro-6-fluorophenyl)acetate
CID 16289650
2-(4-Fluorophenyl)-1-(morpholin-4-yl)ethan-1-one
CID 798469
(2E)-3-(2-chlorophenyl)-1-(2,6-dimethylmorpholin-4-yl)prop-2-en-1-one
CID 5731106
Ethyl 1-[2-(2-chloro-6-fluorophenyl)acetyl]piperidine-4-carboxylate
CID 1094120
[1-(4-Chloro-phenyl)-cyclopentyl]-morpholin-4-yl-methanone
CID 2201258
(E)-3-(2-chlorophenyl)-1-morpholin-4-yl-2-phenylprop-2-en-1-one
CID 2286301

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone (CID 17381748) is 2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone is CC1CN(C(=O)Cc2c(F)cccc2Cl)CC(C)O1.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
The InChIKey is OBZUZHKAVRXCRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClFNO2/c1-9-7-17(8-10(2)19-9)14(18)6-11-12(15)4-3-5-13(11)16/h3-5,9-10H,6-8H2,1-2H3.
What are the key properties of 2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone has a molecular weight of 285.75 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-1-(2,6-dimethylmorpholin-4-yl)ethanone is sourced from PubChem (CID 17381748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).