2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide

C16H19N3O5 — CID 138810701

IUPAC2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide
SMILESNC(=O)c1ccccc1OCC(=O)N1CCC2(CNC(=O)CO2)C1
InChIInChI=1S/C16H19N3O5/c17-15(22)11-3-1-2-4-12(11)23-8-14(21)19-6-5-16(10-19)9-18-13(20)7-24-16/h1-4H,5-10H2,(H2,17,22)(H,18,20)
InChIKeyRTEAQJUCFFNBFV-UHFFFAOYSA-N
MW333.34 g/mol
LogP-0.72
Rot. Bonds4

About 2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide

2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide (PubChem CID 138810701) has the molecular formula C16H19N3O5 and a molecular weight of 333.34 g/mol. Its IUPAC name is 2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide.

Molecular Properties

Compound Name2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide
PubChem CID138810701
Molecular FormulaC16H19N3O5
Molecular Weight333.34 g/mol
Exact Mass333.13
IUPAC Name2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide
SMILESNC(=O)c1ccccc1OCC(=O)N1CCC2(CNC(=O)CO2)C1
InChIInChI=1S/C16H19N3O5/c17-15(22)11-3-1-2-4-12(11)23-8-14(21)19-6-5-16(10-19)9-18-13(20)7-24-16/h1-4H,5-10H2,(H2,17,22)(H,18,20)
InChIKeyRTEAQJUCFFNBFV-UHFFFAOYSA-N
XLogP-0.72
TPSA110.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.34
LogP ≤ 5-0.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethoxy]benzamide
CID 7283920
acetic acid;2-[2-[3a-(hydroxymethyl)-1,2,3,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-2-oxoethoxy]benzamide
CID 171321470
2-(5-chloropyridine-2-carbonyl)-6-oxa-2,9-diazaspiro[4.5]decan-8-one
CID 139598609
2-[2-[(3S)-3-hydroxypiperidin-1-yl]-2-oxoethoxy]benzamide
CID 107224218
2-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethoxy]benzamide
CID 7283918
2-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethoxy]benzamide
CID 38859014
9-[3-(2-methyl-6-oxo-1-pyridinyl)propanoyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 162631980
2-[5-(3-chlorophenyl)naphthalene-1-carbonyl]-6-oxa-2,9-diazaspiro[4.5]decan-8-one
CID 172671620
1'-[2-(2-fluorophenoxy)acetyl]spiro[3,4-dihydro-1,4-benzoxazepine-2,3'-piperidine]-5-one
CID 110213208
2-[2-oxo-2-[4-(2-phenoxyethyl)piperazin-1-yl]ethoxy]benzamide
CID 38858953
2-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)-6-oxa-2,9-diazaspiro[4.5]decan-8-one
CID 176500676
1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-(2-methoxyphenoxy)ethanone
CID 82038149

Frequently Asked Questions

What is the IUPAC name of 2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide?
The IUPAC name of 2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide (CID 138810701) is 2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide.
What is the SMILES notation for 2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide?
The canonical SMILES for 2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide is NC(=O)c1ccccc1OCC(=O)N1CCC2(CNC(=O)CO2)C1.
What is the InChIKey of 2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide?
The InChIKey is RTEAQJUCFFNBFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O5/c17-15(22)11-3-1-2-4-12(11)23-8-14(21)19-6-5-16(10-19)9-18-13(20)7-24-16/h1-4H,5-10H2,(H2,17,22)(H,18,20).
What are the key properties of 2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide?
2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide has a molecular weight of 333.34 g/mol, XLogP of -0.72, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-oxo-2-(8-oxo-6-oxa-2,9-diazaspiro[4.5]decan-2-yl)ethoxy]benzamide is sourced from PubChem (CID 138810701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).