1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone

C17H15FO2 — CID 43413398

IUPAC1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone
SMILESO=C(COc1cccc(F)c1)c1ccc2c(c1)CCC2
InChIInChI=1S/C17H15FO2/c18-15-5-2-6-16(10-15)20-11-17(19)14-8-7-12-3-1-4-13(12)9-14/h2,5-10H,1,3-4,11H2
InChIKeyIUWKVCLNVIXPJG-UHFFFAOYSA-N
MW270.30 g/mol
LogP3.58
Rot. Bonds4

About 1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone

1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone (PubChem CID 43413398) has the molecular formula C17H15FO2 and a molecular weight of 270.30 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone
PubChem CID43413398
Molecular FormulaC17H15FO2
Molecular Weight270.30 g/mol
Exact Mass270.11
IUPAC Name1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone
SMILESO=C(COc1cccc(F)c1)c1ccc2c(c1)CCC2
InChIInChI=1S/C17H15FO2/c18-15-5-2-6-16(10-15)20-11-17(19)14-8-7-12-3-1-4-13(12)9-14/h2,5-10H,1,3-4,11H2
InChIKeyIUWKVCLNVIXPJG-UHFFFAOYSA-N
XLogP3.58
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.30
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluoro-4-methylphenoxy)ethanone
CID 107169810
1-(3,4-dimethylphenyl)-2-(3-fluorophenoxy)ethanone
CID 43413436
2-(2,6-dichlorophenoxy)-1-(2,3-dihydro-1H-inden-5-yl)ethanone
CID 63567111
2-(3-fluorophenoxy)-1-(4-iodophenyl)ethanone
CID 43218799
1-(2,3-dihydro-1H-inden-5-yl)-2-(2,3,5,6-tetrafluorophenoxy)ethanone
CID 112778139
2-(3-fluorophenoxy)-1-(4-methoxyphenyl)ethanone
CID 43413421
[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] 2-[(3-fluorobenzoyl)amino]acetate
CID 8662535
2-(4-iodophenoxy)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanone
CID 2953479
1-(4-chlorophenyl)-2-(2,3-dihydro-1H-inden-5-yloxy)ethanone
CID 43411846
1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluoroanilino)ethanone
CID 82123612
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(3-fluorophenyl)acetamide
CID 2611402
2-(3-fluorophenoxy)-1-(4-propan-2-ylphenyl)ethanone
CID 43413435

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone?
The IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone (CID 43413398) is 1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone is O=C(COc1cccc(F)c1)c1ccc2c(c1)CCC2.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone?
The InChIKey is IUWKVCLNVIXPJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FO2/c18-15-5-2-6-16(10-15)20-11-17(19)14-8-7-12-3-1-4-13(12)9-14/h2,5-10H,1,3-4,11H2.
What are the key properties of 1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone?
1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone has a molecular weight of 270.30 g/mol, XLogP of 3.58, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-5-yl)-2-(3-fluorophenoxy)ethanone is sourced from PubChem (CID 43413398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).