1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone

C18H17ClFNO2 — CID 110326972

IUPAC1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone
SMILESO=C(Cc1ccc(F)cc1)N1CCOC(c2cccc(Cl)c2)C1
InChIInChI=1S/C18H17ClFNO2/c19-15-3-1-2-14(11-15)17-12-21(8-9-23-17)18(22)10-13-4-6-16(20)7-5-13/h1-7,11,17H,8-10,12H2
InChIKeyJZPOINAQECONDI-UHFFFAOYSA-N
MW333.79 g/mol
LogP3.62
Rot. Bonds3

About 1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone

1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone (PubChem CID 110326972) has the molecular formula C18H17ClFNO2 and a molecular weight of 333.79 g/mol. Its IUPAC name is 1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone.

Molecular Properties

Compound Name1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone
PubChem CID110326972
Molecular FormulaC18H17ClFNO2
Molecular Weight333.79 g/mol
Exact Mass333.09
IUPAC Name1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone
SMILESO=C(Cc1ccc(F)cc1)N1CCOC(c2cccc(Cl)c2)C1
InChIInChI=1S/C18H17ClFNO2/c19-15-3-1-2-14(11-15)17-12-21(8-9-23-17)18(22)10-13-4-6-16(20)7-5-13/h1-7,11,17H,8-10,12H2
InChIKeyJZPOINAQECONDI-UHFFFAOYSA-N
XLogP3.62
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.79
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2R)-2-(3-chlorophenyl)morpholin-4-yl]-2-(1H-pyrazol-5-yl)ethanone
CID 124618430
1-[2-(4-ethylphenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone
CID 110364011
2-(4-fluorophenyl)-1-[2-(4-methoxyphenyl)morpholin-4-yl]ethanone
CID 110327189
N-[3-[2-(3-chlorophenyl)morpholin-4-yl]-3-oxopropyl]acetamide
CID 110355151
1-[(2S)-2-(3-chlorophenyl)morpholin-4-yl]-5-methylsulfanylpentan-1-one
CID 124618590
1-(2-chlorophenyl)-4-[2-(3-chlorophenyl)morpholin-4-yl]butane-1,4-dione
CID 110416762
1-[2-(3,5-dichlorophenyl)morpholin-4-yl]-2-(4-ethoxyphenyl)ethanone
CID 121134501
1-[2-(3-chlorophenyl)morpholin-4-yl]-3-(furan-2-yl)propan-1-one
CID 110356623
2-(3-fluorophenyl)-1-(2-pyridin-4-ylmorpholin-4-yl)ethanone
CID 155983401
2-chloro-1-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]ethanone
CID 51889846
1-[2-(3-chlorophenyl)morpholin-4-yl]-3-(1H-imidazol-5-yl)propan-1-one
CID 146131766
[2-(3-chlorophenyl)morpholin-4-yl]-[3-(methoxymethyl)phenyl]methanone
CID 122138903

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone?
The IUPAC name of 1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone (CID 110326972) is 1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone.
What is the SMILES notation for 1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone?
The canonical SMILES for 1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone is O=C(Cc1ccc(F)cc1)N1CCOC(c2cccc(Cl)c2)C1.
What is the InChIKey of 1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone?
The InChIKey is JZPOINAQECONDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClFNO2/c19-15-3-1-2-14(11-15)17-12-21(8-9-23-17)18(22)10-13-4-6-16(20)7-5-13/h1-7,11,17H,8-10,12H2.
What are the key properties of 1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone?
1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone has a molecular weight of 333.79 g/mol, XLogP of 3.62, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-chlorophenyl)morpholin-4-yl]-2-(4-fluorophenyl)ethanone is sourced from PubChem (CID 110326972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).