8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one

C16H18N2O3 — CID 645886

IUPAC8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one
SMILESCCc1cccc2c(=O)c(C(=O)N3CCOCC3)c[nH]c12
InChIInChI=1S/C16H18N2O3/c1-2-11-4-3-5-12-14(11)17-10-13(15(12)19)16(20)18-6-8-21-9-7-18/h3-5,10H,2,6-9H2,1H3,(H,17,19)
InChIKeyFKTVWNYHCLDGPI-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.56
Rot. Bonds2

About 8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one

8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one (PubChem CID 645886) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one.

Molecular Properties

Compound Name8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one
PubChem CID645886
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one
SMILESCCc1cccc2c(=O)c(C(=O)N3CCOCC3)c[nH]c12
InChIInChI=1S/C16H18N2O3/c1-2-11-4-3-5-12-14(11)17-10-13(15(12)19)16(20)18-6-8-21-9-7-18/h3-5,10H,2,6-9H2,1H3,(H,17,19)
InChIKeyFKTVWNYHCLDGPI-UHFFFAOYSA-N
XLogP1.56
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one?
The IUPAC name of 8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one (CID 645886) is 8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one.
What is the SMILES notation for 8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one?
The canonical SMILES for 8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one is CCc1cccc2c(=O)c(C(=O)N3CCOCC3)c[nH]c12.
What is the InChIKey of 8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one?
The InChIKey is FKTVWNYHCLDGPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-2-11-4-3-5-12-14(11)17-10-13(15(12)19)16(20)18-6-8-21-9-7-18/h3-5,10H,2,6-9H2,1H3,(H,17,19).
What are the key properties of 8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one?
8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one has a molecular weight of 286.33 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-3-(morpholine-4-carbonyl)-1H-quinolin-4-one is sourced from PubChem (CID 645886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).