4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one

C19H24N2O4 — CID 42690262

IUPAC4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one
SMILESCCCn1c(=O)cc(C)c2ccc(OCC(=O)N3CCOCC3)cc21
InChIInChI=1S/C19H24N2O4/c1-3-6-21-17-12-15(4-5-16(17)14(2)11-18(21)22)25-13-19(23)20-7-9-24-10-8-20/h4-5,11-12H,3,6-10,13H2,1-2H3
InChIKeyYWCMXKWIUOTHOJ-UHFFFAOYSA-N
MW344.41 g/mol
LogP1.96
Rot. Bonds5

About 4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one

4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one (PubChem CID 42690262) has the molecular formula C19H24N2O4 and a molecular weight of 344.41 g/mol. Its IUPAC name is 4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one.

Molecular Properties

Compound Name4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one
PubChem CID42690262
Molecular FormulaC19H24N2O4
Molecular Weight344.41 g/mol
Exact Mass344.17
IUPAC Name4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one
SMILESCCCn1c(=O)cc(C)c2ccc(OCC(=O)N3CCOCC3)cc21
InChIInChI=1S/C19H24N2O4/c1-3-6-21-17-12-15(4-5-16(17)14(2)11-18(21)22)25-13-19(23)20-7-9-24-10-8-20/h4-5,11-12H,3,6-10,13H2,1-2H3
InChIKeyYWCMXKWIUOTHOJ-UHFFFAOYSA-N
XLogP1.96
TPSA60.77 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one?
The IUPAC name of 4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one (CID 42690262) is 4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one.
What is the SMILES notation for 4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one?
The canonical SMILES for 4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one is CCCn1c(=O)cc(C)c2ccc(OCC(=O)N3CCOCC3)cc21.
What is the InChIKey of 4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one?
The InChIKey is YWCMXKWIUOTHOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4/c1-3-6-21-17-12-15(4-5-16(17)14(2)11-18(21)22)25-13-19(23)20-7-9-24-10-8-20/h4-5,11-12H,3,6-10,13H2,1-2H3.
What are the key properties of 4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one?
4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one has a molecular weight of 344.41 g/mol, XLogP of 1.96, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-7-(2-morpholin-4-yl-2-oxoethoxy)-1-propylquinolin-2-one is sourced from PubChem (CID 42690262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).