5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one

C19H23N3O4 — CID 166373053

IUPAC5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one
SMILESCC(=O)N1CCOC2(CCN(C(=O)c3ccc4c(c3)CC(=O)N4)CC2)C1
InChIInChI=1S/C19H23N3O4/c1-13(23)22-8-9-26-19(12-22)4-6-21(7-5-19)18(25)14-2-3-16-15(10-14)11-17(24)20-16/h2-3,10H,4-9,11-12H2,1H3,(H,20,24)
InChIKeyUPNJKADJRAXXKZ-UHFFFAOYSA-N
MW357.41 g/mol
LogP1.03
Rot. Bonds1

About 5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one

5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one (PubChem CID 166373053) has the molecular formula C19H23N3O4 and a molecular weight of 357.41 g/mol. Its IUPAC name is 5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one
PubChem CID166373053
Molecular FormulaC19H23N3O4
Molecular Weight357.41 g/mol
Exact Mass357.17
IUPAC Name5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one
SMILESCC(=O)N1CCOC2(CCN(C(=O)c3ccc4c(c3)CC(=O)N4)CC2)C1
InChIInChI=1S/C19H23N3O4/c1-13(23)22-8-9-26-19(12-22)4-6-21(7-5-19)18(25)14-2-3-16-15(10-14)11-17(24)20-16/h2-3,10H,4-9,11-12H2,1H3,(H,20,24)
InChIKeyUPNJKADJRAXXKZ-UHFFFAOYSA-N
XLogP1.03
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one with MolForge

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Related Compounds

5-[4-methyl-4-(methylamino)piperidine-1-carbonyl]-1,3-dihydroindol-2-one
CID 102711671
5-(thiomorpholine-4-carbonyl)-1,3-dihydroindol-2-one
CID 113225087
4,4-dimethyl-6-(morpholine-4-carbonyl)-1,3-dihydroquinolin-2-one
CID 91946268
6-chloro-7-methyl-1'-(2-oxo-1,3-dihydroindole-5-carbonyl)spiro[3H-chromene-2,4'-piperidine]-4-one
CID 108809038
5-(3-hydroxy-3-methylpiperidine-1-carbonyl)-1,3-dihydroindol-2-one
CID 103878855
4-(2-oxo-1,3-dihydroindole-5-carbonyl)piperazine-2,6-dione
CID 102712522
5-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-1,3-dihydroindol-2-one
CID 110800434
5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one
CID 102711392
5-(3,6-dihydro-2H-pyridine-1-carbonyl)-1,3-dihydroindol-2-one
CID 113356774
5-[4-(aminomethyl)piperidine-1-carbonyl]-1,3-dihydroindol-2-one
CID 102711455
5-(4-ethylsulfonyl-1,4-diazepane-1-carbonyl)-1,3-dihydroindol-2-one
CID 110810080
5-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)-1,3-dihydroindol-2-one
CID 110809888

Frequently Asked Questions

What is the IUPAC name of 5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one?
The IUPAC name of 5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one (CID 166373053) is 5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one?
The canonical SMILES for 5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one is CC(=O)N1CCOC2(CCN(C(=O)c3ccc4c(c3)CC(=O)N4)CC2)C1.
What is the InChIKey of 5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one?
The InChIKey is UPNJKADJRAXXKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4/c1-13(23)22-8-9-26-19(12-22)4-6-21(7-5-19)18(25)14-2-3-16-15(10-14)11-17(24)20-16/h2-3,10H,4-9,11-12H2,1H3,(H,20,24).
What are the key properties of 5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one?
5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one has a molecular weight of 357.41 g/mol, XLogP of 1.03, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-acetyl-1-oxa-4,9-diazaspiro[5.5]undecane-9-carbonyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 166373053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).