ethyl 3-(2-fluorophenyl)indolizine-1-carboxylate

C17H14FNO2 — CID 102531294

IUPACethyl 3-(2-fluorophenyl)indolizine-1-carboxylate
SMILESCCOC(=O)c1cc(-c2ccccc2F)n2ccccc12
InChIInChI=1S/C17H14FNO2/c1-2-21-17(20)13-11-16(12-7-3-4-8-14(12)18)19-10-6-5-9-15(13)19/h3-11H,2H2,1H3
InChIKeyFMGOQTRWUKDRNM-UHFFFAOYSA-N
MW283.30 g/mol
LogP3.92
Rot. Bonds3

About ethyl 3-(2-fluorophenyl)indolizine-1-carboxylate

ethyl 3-(2-fluorophenyl)indolizine-1-carboxylate (PubChem CID 102531294) has the molecular formula C17H14FNO2 and a molecular weight of 283.30 g/mol. Its IUPAC name is ethyl 3-(2-fluorophenyl)indolizine-1-carboxylate.

Molecular Properties

Compound Nameethyl 3-(2-fluorophenyl)indolizine-1-carboxylate
PubChem CID102531294
Molecular FormulaC17H14FNO2
Molecular Weight283.30 g/mol
Exact Mass283.10
IUPAC Nameethyl 3-(2-fluorophenyl)indolizine-1-carboxylate
SMILESCCOC(=O)c1cc(-c2ccccc2F)n2ccccc12
InChIInChI=1S/C17H14FNO2/c1-2-21-17(20)13-11-16(12-7-3-4-8-14(12)18)19-10-6-5-9-15(13)19/h3-11H,2H2,1H3
InChIKeyFMGOQTRWUKDRNM-UHFFFAOYSA-N
XLogP3.92
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.30
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl 3-(2-fluorophenyl)indolizine-1-carboxylate?
The IUPAC name of ethyl 3-(2-fluorophenyl)indolizine-1-carboxylate (CID 102531294) is ethyl 3-(2-fluorophenyl)indolizine-1-carboxylate.
What is the SMILES notation for ethyl 3-(2-fluorophenyl)indolizine-1-carboxylate?
The canonical SMILES for ethyl 3-(2-fluorophenyl)indolizine-1-carboxylate is CCOC(=O)c1cc(-c2ccccc2F)n2ccccc12.
What is the InChIKey of ethyl 3-(2-fluorophenyl)indolizine-1-carboxylate?
The InChIKey is FMGOQTRWUKDRNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO2/c1-2-21-17(20)13-11-16(12-7-3-4-8-14(12)18)19-10-6-5-9-15(13)19/h3-11H,2H2,1H3.
What are the key properties of ethyl 3-(2-fluorophenyl)indolizine-1-carboxylate?
ethyl 3-(2-fluorophenyl)indolizine-1-carboxylate has a molecular weight of 283.30 g/mol, XLogP of 3.92, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-(2-fluorophenyl)indolizine-1-carboxylate is sourced from PubChem (CID 102531294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).