2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one

C19H23N3O4 — CID 138806837

IUPAC2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one
SMILESCCOc1ccc2[nH]c(=O)c(CN3CCC4(CNC(=O)CO4)C3)cc2c1
InChIInChI=1S/C19H23N3O4/c1-2-25-15-3-4-16-13(8-15)7-14(18(24)21-16)9-22-6-5-19(12-22)11-20-17(23)10-26-19/h3-4,7-8H,2,5-6,9-12H2,1H3,(H,20,23)(H,21,24)
InChIKeyORURWFNUAPSCEJ-UHFFFAOYSA-N
MW357.41 g/mol
LogP1.02
Rot. Bonds4

About 2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one

2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one (PubChem CID 138806837) has the molecular formula C19H23N3O4 and a molecular weight of 357.41 g/mol. Its IUPAC name is 2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one.

Molecular Properties

Compound Name2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one
PubChem CID138806837
Molecular FormulaC19H23N3O4
Molecular Weight357.41 g/mol
Exact Mass357.17
IUPAC Name2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one
SMILESCCOc1ccc2[nH]c(=O)c(CN3CCC4(CNC(=O)CO4)C3)cc2c1
InChIInChI=1S/C19H23N3O4/c1-2-25-15-3-4-16-13(8-15)7-14(18(24)21-16)9-22-6-5-19(12-22)11-20-17(23)10-26-19/h3-4,7-8H,2,5-6,9-12H2,1H3,(H,20,23)(H,21,24)
InChIKeyORURWFNUAPSCEJ-UHFFFAOYSA-N
XLogP1.02
TPSA83.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(2-methoxy-4-phenylmethoxyphenyl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one
CID 138387630
6-ethoxy-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one
CID 170870835
6-ethoxy-3-(hydroxymethyl)-1H-quinolin-2-one
CID 865121
(3S)-3-amino-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]pyrrolidine-3-carboxylic acid
CID 95229329
6-ethoxy-3-[[3-(2-methylpiperidin-1-yl)azetidin-1-yl]methyl]-1H-quinolin-2-one
CID 56722379
6-ethoxy-3-[[(3S,4R)-3-hydroxy-4-(pyrazin-2-ylmethyl)pyrrolidin-1-yl]methyl]-1H-quinolin-2-one
CID 134704843
3-[[(4aR,8aS)-2,3,4,4a,5,7,8,8a-octahydro-1H-1,6-naphthyridin-6-yl]methyl]-6-ethoxy-1H-quinolin-2-one;dihydrochloride
CID 154884368
2-[[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one
CID 138387872
9-[(5-methoxy-2-pyrazol-1-ylphenyl)methyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 162630357
6-ethoxy-3-[[[1-(methoxymethyl)cyclopropyl]-methylamino]methyl]-1H-quinolin-2-one
CID 56714540
9-[(1-methyl-2-oxoquinolin-3-yl)methyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 163308018
2-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one
CID 138383083

Frequently Asked Questions

What is the IUPAC name of 2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one?
The IUPAC name of 2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one (CID 138806837) is 2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one.
What is the SMILES notation for 2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one?
The canonical SMILES for 2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one is CCOc1ccc2[nH]c(=O)c(CN3CCC4(CNC(=O)CO4)C3)cc2c1.
What is the InChIKey of 2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one?
The InChIKey is ORURWFNUAPSCEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4/c1-2-25-15-3-4-16-13(8-15)7-14(18(24)21-16)9-22-6-5-19(12-22)11-20-17(23)10-26-19/h3-4,7-8H,2,5-6,9-12H2,1H3,(H,20,23)(H,21,24).
What are the key properties of 2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one?
2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one has a molecular weight of 357.41 g/mol, XLogP of 1.02, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one is sourced from PubChem (CID 138806837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).