9-oxa-2,6-diazaspiro[4.5]decan-1-one

C7H12N2O2 — CID 165458993

IUPAC9-oxa-2,6-diazaspiro[4.5]decan-1-one
SMILESO=C1NCCC12COCCN2
InChIInChI=1S/C7H12N2O2/c10-6-7(1-2-8-6)5-11-4-3-9-7/h9H,1-5H2,(H,8,10)
InChIKeyQSJCDTQQPNVTPG-UHFFFAOYSA-N
MW156.18 g/mol
LogP-1.14
Rot. Bonds

About 9-oxa-2,6-diazaspiro[4.5]decan-1-one

9-oxa-2,6-diazaspiro[4.5]decan-1-one (PubChem CID 165458993) has the molecular formula C7H12N2O2 and a molecular weight of 156.18 g/mol. Its IUPAC name is 9-oxa-2,6-diazaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name9-oxa-2,6-diazaspiro[4.5]decan-1-one
PubChem CID165458993
Molecular FormulaC7H12N2O2
Molecular Weight156.18 g/mol
Exact Mass156.09
IUPAC Name9-oxa-2,6-diazaspiro[4.5]decan-1-one
SMILESO=C1NCCC12COCCN2
InChIInChI=1S/C7H12N2O2/c10-6-7(1-2-8-6)5-11-4-3-9-7/h9H,1-5H2,(H,8,10)
InChIKeyQSJCDTQQPNVTPG-UHFFFAOYSA-N
XLogP-1.14
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.18
LogP ≤ 5-1.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(5S)-2-oxa-6,9-diazaspiro[4.5]decan-10-one
CID 129370053
8,11-dioxa-1,4-diazaspiro[5.6]dodecan-5-one
CID 89003952
1,4,9-triazaspiro[5.5]undecan-5-one;dihydrochloride
CID 86812140
1,7-diazaspiro[4.4]nonane-3,6-dione
CID 105430037
(4R)-1,6-diazaspiro[3.3]heptan-7-one
CID 171035437
spiro[1,2-dihydroindene-3,3'-morpholine]
CID 66995999
(4R)-2,5-diazaspiro[3.4]octan-3-one
CID 97170263
7-oxa-4-azaspiro[2.5]octane;hydrochloride
CID 22342972
2-sulfanylidene-7-oxa-1,3-diazaspiro[4.4]nonan-4-one
CID 82997968
9-methyl-1,4-diazaspiro[5.5]undecan-5-one
CID 54773629
2-oxa-5,7-diazaspiro[3.4]octane-6,8-dione
CID 19811070
2,5,9-triazaspiro[3.6]decan-10-one;dihydrochloride
CID 162422730

Frequently Asked Questions

What is the IUPAC name of 9-oxa-2,6-diazaspiro[4.5]decan-1-one?
The IUPAC name of 9-oxa-2,6-diazaspiro[4.5]decan-1-one (CID 165458993) is 9-oxa-2,6-diazaspiro[4.5]decan-1-one.
What is the SMILES notation for 9-oxa-2,6-diazaspiro[4.5]decan-1-one?
The canonical SMILES for 9-oxa-2,6-diazaspiro[4.5]decan-1-one is O=C1NCCC12COCCN2.
What is the InChIKey of 9-oxa-2,6-diazaspiro[4.5]decan-1-one?
The InChIKey is QSJCDTQQPNVTPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c10-6-7(1-2-8-6)5-11-4-3-9-7/h9H,1-5H2,(H,8,10).
What are the key properties of 9-oxa-2,6-diazaspiro[4.5]decan-1-one?
9-oxa-2,6-diazaspiro[4.5]decan-1-one has a molecular weight of 156.18 g/mol, XLogP of -1.14, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-oxa-2,6-diazaspiro[4.5]decan-1-one is sourced from PubChem (CID 165458993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).