1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone

C14H14FNO3 — CID 114736887

IUPAC1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone
SMILESO=C(CC1CNCCO1)c1cc2cccc(F)c2o1
InChIInChI=1S/C14H14FNO3/c15-11-3-1-2-9-6-13(19-14(9)11)12(17)7-10-8-16-4-5-18-10/h1-3,6,10,16H,4-5,7-8H2
InChIKeyMCYFTZBJNPWBGZ-UHFFFAOYSA-N
MW263.27 g/mol
LogP2.13
Rot. Bonds3

About 1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone

1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone (PubChem CID 114736887) has the molecular formula C14H14FNO3 and a molecular weight of 263.27 g/mol. Its IUPAC name is 1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone.

Molecular Properties

Compound Name1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone
PubChem CID114736887
Molecular FormulaC14H14FNO3
Molecular Weight263.27 g/mol
Exact Mass263.10
IUPAC Name1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone
SMILESO=C(CC1CNCCO1)c1cc2cccc(F)c2o1
InChIInChI=1S/C14H14FNO3/c15-11-3-1-2-9-6-13(19-14(9)11)12(17)7-10-8-16-4-5-18-10/h1-3,6,10,16H,4-5,7-8H2
InChIKeyMCYFTZBJNPWBGZ-UHFFFAOYSA-N
XLogP2.13
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.27
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cycloheptyl-1-(7-fluoro-1-benzofuran-2-yl)ethanone
CID 115809805
7-bromo-N-(morpholin-2-ylmethyl)-1-benzofuran-2-carboxamide
CID 115323833
2-(azetidin-3-yl)-1-(7-methyl-1-benzofuran-2-yl)ethanone
CID 114736814
1-(2-chloro-5-fluorophenyl)-2-morpholin-2-ylethanone
CID 105396502
1-(5-fluoro-2-methylphenyl)-2-morpholin-2-ylethanone
CID 116586161
2-morpholin-2-yl-1-(3-propylphenyl)ethanone
CID 116586299
1-(4-chlorophenyl)-2-morpholin-2-ylethanone
CID 116586223
1-(7-methyl-1-benzofuran-2-yl)-2-piperidin-4-ylethanone
CID 114736371
1-(7-fluoro-1-benzofuran-2-yl)-2-methyl-2-piperidin-3-ylpropan-1-one
CID 114737366
2-(azetidin-3-yl)-1-(7-chloro-1-benzofuran-2-yl)ethanone
CID 114736812
1-(3-fluoro-5-methylphenyl)-2-morpholin-2-ylethanone
CID 116586217
N-(2-fluoro-6-nitrophenyl)-2-morpholin-2-ylacetamide
CID 81311080

Frequently Asked Questions

What is the IUPAC name of 1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone?
The IUPAC name of 1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone (CID 114736887) is 1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone.
What is the SMILES notation for 1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone?
The canonical SMILES for 1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone is O=C(CC1CNCCO1)c1cc2cccc(F)c2o1.
What is the InChIKey of 1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone?
The InChIKey is MCYFTZBJNPWBGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO3/c15-11-3-1-2-9-6-13(19-14(9)11)12(17)7-10-8-16-4-5-18-10/h1-3,6,10,16H,4-5,7-8H2.
What are the key properties of 1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone?
1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone has a molecular weight of 263.27 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-fluoro-1-benzofuran-2-yl)-2-morpholin-2-ylethanone is sourced from PubChem (CID 114736887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).