11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline

C17H12FNO — CID 118101239

IUPAC11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline
SMILESCCc1c2cc(F)ccc2nc2c1oc1ccccc12
InChIInChI=1S/C17H12FNO/c1-2-11-13-9-10(18)7-8-14(13)19-16-12-5-3-4-6-15(12)20-17(11)16/h3-9H,2H2,1H3
InChIKeyVGDGVMCMBSLLIB-UHFFFAOYSA-N
MW265.29 g/mol
LogP4.84
Rot. Bonds1

About 11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline

11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline (PubChem CID 118101239) has the molecular formula C17H12FNO and a molecular weight of 265.29 g/mol. Its IUPAC name is 11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline.

Molecular Properties

Compound Name11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline
PubChem CID118101239
Molecular FormulaC17H12FNO
Molecular Weight265.29 g/mol
Exact Mass265.09
IUPAC Name11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline
SMILESCCc1c2cc(F)ccc2nc2c1oc1ccccc12
InChIInChI=1S/C17H12FNO/c1-2-11-13-9-10(18)7-8-14(13)19-16-12-5-3-4-6-15(12)20-17(11)16/h3-9H,2H2,1H3
InChIKeyVGDGVMCMBSLLIB-UHFFFAOYSA-N
XLogP4.84
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.29
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline?
The IUPAC name of 11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline (CID 118101239) is 11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline.
What is the SMILES notation for 11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline?
The canonical SMILES for 11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline is CCc1c2cc(F)ccc2nc2c1oc1ccccc12.
What is the InChIKey of 11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline?
The InChIKey is VGDGVMCMBSLLIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12FNO/c1-2-11-13-9-10(18)7-8-14(13)19-16-12-5-3-4-6-15(12)20-17(11)16/h3-9H,2H2,1H3.
What are the key properties of 11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline?
11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline has a molecular weight of 265.29 g/mol, XLogP of 4.84, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-ethyl-2-fluoro-[1]benzofuro[3,2-b]quinoline is sourced from PubChem (CID 118101239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).