1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one

C16H20N2O3 — CID 53013938

IUPAC1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one
SMILESCCN1C(=O)CCc2cc(C(=O)N3CCOCC3)ccc21
InChIInChI=1S/C16H20N2O3/c1-2-18-14-5-3-13(11-12(14)4-6-15(18)19)16(20)17-7-9-21-10-8-17/h3,5,11H,2,4,6-10H2,1H3
InChIKeyKLSFXGWVOHSDRH-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.46
Rot. Bonds2

About 1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one

1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one (PubChem CID 53013938) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is 1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one
PubChem CID53013938
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC Name1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one
SMILESCCN1C(=O)CCc2cc(C(=O)N3CCOCC3)ccc21
InChIInChI=1S/C16H20N2O3/c1-2-18-14-5-3-13(11-12(14)4-6-15(18)19)16(20)17-7-9-21-10-8-17/h3,5,11H,2,4,6-10H2,1H3
InChIKeyKLSFXGWVOHSDRH-UHFFFAOYSA-N
XLogP1.46
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one?
The IUPAC name of 1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one (CID 53013938) is 1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one?
The canonical SMILES for 1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one is CCN1C(=O)CCc2cc(C(=O)N3CCOCC3)ccc21.
What is the InChIKey of 1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one?
The InChIKey is KLSFXGWVOHSDRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-2-18-14-5-3-13(11-12(14)4-6-15(18)19)16(20)17-7-9-21-10-8-17/h3,5,11H,2,4,6-10H2,1H3.
What are the key properties of 1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one?
1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one has a molecular weight of 288.35 g/mol, XLogP of 1.46, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-(morpholine-4-carbonyl)-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 53013938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).