6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid

C16H14FNO3 — CID 66844924

IUPAC6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid
SMILESCC1CCc2c(C(=O)O)cc(-c3ccccc3F)c(=O)n21
InChIInChI=1S/C16H14FNO3/c1-9-6-7-14-12(16(20)21)8-11(15(19)18(9)14)10-4-2-3-5-13(10)17/h2-5,8-9H,6-7H2,1H3,(H,20,21)
InChIKeyGJDLPJITLGIOLA-UHFFFAOYSA-N
MW287.29 g/mol
LogP2.86
Rot. Bonds2

About 6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid

6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid (PubChem CID 66844924) has the molecular formula C16H14FNO3 and a molecular weight of 287.29 g/mol. Its IUPAC name is 6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid.

Molecular Properties

Compound Name6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid
PubChem CID66844924
Molecular FormulaC16H14FNO3
Molecular Weight287.29 g/mol
Exact Mass287.10
IUPAC Name6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid
SMILESCC1CCc2c(C(=O)O)cc(-c3ccccc3F)c(=O)n21
InChIInChI=1S/C16H14FNO3/c1-9-6-7-14-12(16(20)21)8-11(15(19)18(9)14)10-4-2-3-5-13(10)17/h2-5,8-9H,6-7H2,1H3,(H,20,21)
InChIKeyGJDLPJITLGIOLA-UHFFFAOYSA-N
XLogP2.86
TPSA59.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.29
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid?
The IUPAC name of 6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid (CID 66844924) is 6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid.
What is the SMILES notation for 6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid?
The canonical SMILES for 6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid is CC1CCc2c(C(=O)O)cc(-c3ccccc3F)c(=O)n21.
What is the InChIKey of 6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid?
The InChIKey is GJDLPJITLGIOLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FNO3/c1-9-6-7-14-12(16(20)21)8-11(15(19)18(9)14)10-4-2-3-5-13(10)17/h2-5,8-9H,6-7H2,1H3,(H,20,21).
What are the key properties of 6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid?
6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid has a molecular weight of 287.29 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluorophenyl)-3-methyl-5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid is sourced from PubChem (CID 66844924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).