6-ethoxy-2-ethyl-1H-quinolin-4-one

C13H15NO2 — CID 43668050

IUPAC6-ethoxy-2-ethyl-1H-quinolin-4-one
SMILESCCOc1ccc2[nH]c(CC)cc(=O)c2c1
InChIInChI=1S/C13H15NO2/c1-3-9-7-13(15)11-8-10(16-4-2)5-6-12(11)14-9/h5-8H,3-4H2,1-2H3,(H,14,15)
InChIKeyKCAORSCCUJBIEW-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.49
Rot. Bonds3

About 6-ethoxy-2-ethyl-1H-quinolin-4-one

6-ethoxy-2-ethyl-1H-quinolin-4-one (PubChem CID 43668050) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is 6-ethoxy-2-ethyl-1H-quinolin-4-one.

Molecular Properties

Compound Name6-ethoxy-2-ethyl-1H-quinolin-4-one
PubChem CID43668050
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC Name6-ethoxy-2-ethyl-1H-quinolin-4-one
SMILESCCOc1ccc2[nH]c(CC)cc(=O)c2c1
InChIInChI=1S/C13H15NO2/c1-3-9-7-13(15)11-8-10(16-4-2)5-6-12(11)14-9/h5-8H,3-4H2,1-2H3,(H,14,15)
InChIKeyKCAORSCCUJBIEW-UHFFFAOYSA-N
XLogP2.49
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(difluoromethoxy)-2-ethyl-1H-quinolin-4-one
CID 43668344
2,7-diethoxy-10H-acridin-9-one
CID 163923657
6-tert-butyl-2-ethyl-1H-quinolin-4-one
CID 43668294
7-ethoxy-3,4-dihydro-2H-cyclopenta[b]indol-1-one
CID 107958537
4-(bromomethyl)-6-ethoxy-1H-quinolin-2-one
CID 83665775
6-ethoxy-2-ethyl-1H-1,5-naphthyridin-4-one
CID 19890809
2-[[(4-ethoxyphenyl)methyl-propylamino]methyl]-6-methyl-1H-quinolin-4-one
CID 20931387
2-(6-methoxy-4-oxo-1H-quinolin-2-yl)acetamide
CID 25174598
2-tert-butyl-6-propoxy-1H-quinolin-4-one
CID 55059882
6-ethoxy-2-methyl-4-oxo-1H-quinoline-3-carbaldehyde
CID 12594754
5-ethoxy-2-[(5-ethoxy-1H-indol-2-yl)methyl]-1H-indole
CID 54196890
N-(4-ethoxyphenyl)-2-[(6-methyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]acetamide
CID 46355604

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-2-ethyl-1H-quinolin-4-one?
The IUPAC name of 6-ethoxy-2-ethyl-1H-quinolin-4-one (CID 43668050) is 6-ethoxy-2-ethyl-1H-quinolin-4-one.
What is the SMILES notation for 6-ethoxy-2-ethyl-1H-quinolin-4-one?
The canonical SMILES for 6-ethoxy-2-ethyl-1H-quinolin-4-one is CCOc1ccc2[nH]c(CC)cc(=O)c2c1.
What is the InChIKey of 6-ethoxy-2-ethyl-1H-quinolin-4-one?
The InChIKey is KCAORSCCUJBIEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2/c1-3-9-7-13(15)11-8-10(16-4-2)5-6-12(11)14-9/h5-8H,3-4H2,1-2H3,(H,14,15).
What are the key properties of 6-ethoxy-2-ethyl-1H-quinolin-4-one?
6-ethoxy-2-ethyl-1H-quinolin-4-one has a molecular weight of 217.27 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-2-ethyl-1H-quinolin-4-one is sourced from PubChem (CID 43668050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).