8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one

C11H15NO3 — CID 154587219

IUPAC8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one
SMILESC=CC(=O)N1CCC2(CC1)CC(=O)CO2
InChIInChI=1S/C11H15NO3/c1-2-10(14)12-5-3-11(4-6-12)7-9(13)8-15-11/h2H,1,3-8H2
InChIKeyDEZAFUUXNVERNN-UHFFFAOYSA-N
MW209.24 g/mol
LogP0.52
Rot. Bonds1

About 8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one

8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one (PubChem CID 154587219) has the molecular formula C11H15NO3 and a molecular weight of 209.24 g/mol. Its IUPAC name is 8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one.

Molecular Properties

Compound Name8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one
PubChem CID154587219
Molecular FormulaC11H15NO3
Molecular Weight209.24 g/mol
Exact Mass209.11
IUPAC Name8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one
SMILESC=CC(=O)N1CCC2(CC1)CC(=O)CO2
InChIInChI=1S/C11H15NO3/c1-2-10(14)12-5-3-11(4-6-12)7-9(13)8-15-11/h2H,1,3-8H2
InChIKeyDEZAFUUXNVERNN-UHFFFAOYSA-N
XLogP0.52
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.24
LogP ≤ 50.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

5-oxaspiro[3.4]octan-7-one
CID 122163504
7-oxo-5-oxa-2-azaspiro[3.4]octane-2-carboxylic acid
CID 130302935
1-(azetidin-1-yl)prop-2-en-1-one
CID 25230596
N-methyl-3-prop-2-enoyl-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxamide
CID 166144007
1-(4,4-dimethylpiperidin-1-yl)prop-2-en-1-one;ethane;propane
CID 167457745
tert-butyl 3-prop-2-enoyl-1-oxa-3,7-diazaspiro[4.4]nonane-7-carboxylate
CID 166115550
1-(10-fluoro-9-iodo-3-azaspiro[5.5]undec-9-en-3-yl)prop-2-en-1-one
CID 169213291
1-[4-[(4-methylphenyl)methylsulfonyl]-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]prop-2-en-1-one
CID 172887780
8-methylidene-6-oxaspiro[4.5]decan-9-one
CID 102494655
1-spiro[1,3-benzodioxole-2,3'-pyrrolidine]-1'-ylprop-2-en-1-one
CID 126824922
CID 169213217
CID 169213217
ethane;1-[4-(3-hydroxy-3-methylpyrrolidine-1-carbonyl)piperazin-1-yl]prop-2-en-1-one
CID 178147929

Frequently Asked Questions

What is the IUPAC name of 8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one?
The IUPAC name of 8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one (CID 154587219) is 8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one.
What is the SMILES notation for 8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one?
The canonical SMILES for 8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one is C=CC(=O)N1CCC2(CC1)CC(=O)CO2.
What is the InChIKey of 8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one?
The InChIKey is DEZAFUUXNVERNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-2-10(14)12-5-3-11(4-6-12)7-9(13)8-15-11/h2H,1,3-8H2.
What are the key properties of 8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one?
8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one has a molecular weight of 209.24 g/mol, XLogP of 0.52, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-prop-2-enoyl-1-oxa-8-azaspiro[4.5]decan-3-one is sourced from PubChem (CID 154587219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).