3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one

C19H15FN2O — CID 155515144

IUPAC3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one
SMILESCCn1ccc2c3c(=O)cc(-c4cccc(F)c4)[nH]c3ccc21
InChIInChI=1S/C19H15FN2O/c1-2-22-9-8-14-17(22)7-6-15-19(14)18(23)11-16(21-15)12-4-3-5-13(20)10-12/h3-11H,2H2,1H3,(H,21,23)
InChIKeyKUUOTYAPRMXHCC-UHFFFAOYSA-N
MW306.34 g/mol
LogP4.31
Rot. Bonds2

About 3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one

3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one (PubChem CID 155515144) has the molecular formula C19H15FN2O and a molecular weight of 306.34 g/mol. Its IUPAC name is 3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one.

Molecular Properties

Compound Name3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one
PubChem CID155515144
Molecular FormulaC19H15FN2O
Molecular Weight306.34 g/mol
Exact Mass306.12
IUPAC Name3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one
SMILESCCn1ccc2c3c(=O)cc(-c4cccc(F)c4)[nH]c3ccc21
InChIInChI=1S/C19H15FN2O/c1-2-22-9-8-14-17(22)7-6-15-19(14)18(23)11-16(21-15)12-4-3-5-13(20)10-12/h3-11H,2H2,1H3,(H,21,23)
InChIKeyKUUOTYAPRMXHCC-UHFFFAOYSA-N
XLogP4.31
TPSA37.79 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.34
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one?
The IUPAC name of 3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one (CID 155515144) is 3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one.
What is the SMILES notation for 3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one?
The canonical SMILES for 3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one is CCn1ccc2c3c(=O)cc(-c4cccc(F)c4)[nH]c3ccc21.
What is the InChIKey of 3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one?
The InChIKey is KUUOTYAPRMXHCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2O/c1-2-22-9-8-14-17(22)7-6-15-19(14)18(23)11-16(21-15)12-4-3-5-13(20)10-12/h3-11H,2H2,1H3,(H,21,23).
What are the key properties of 3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one?
3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one has a molecular weight of 306.34 g/mol, XLogP of 4.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-7-(3-fluorophenyl)-6H-pyrrolo[3,2-f]quinolin-9-one is sourced from PubChem (CID 155515144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).