7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one

C11H17NO — CID 153378438

IUPAC7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one
SMILESC=CCC1CC2(CCNC2)CC1=O
InChIInChI=1S/C11H17NO/c1-2-3-9-6-11(7-10(9)13)4-5-12-8-11/h2,9,12H,1,3-8H2
InChIKeyANUYQINJLKWAMX-UHFFFAOYSA-N
MW179.26 g/mol
LogP1.52
Rot. Bonds2

About 7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one

7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one (PubChem CID 153378438) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one.

Molecular Properties

Compound Name7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one
PubChem CID153378438
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one
SMILESC=CCC1CC2(CCNC2)CC1=O
InChIInChI=1S/C11H17NO/c1-2-3-9-6-11(7-10(9)13)4-5-12-8-11/h2,9,12H,1,3-8H2
InChIKeyANUYQINJLKWAMX-UHFFFAOYSA-N
XLogP1.52
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 7-prop-2-enyl-2-azaspiro[4.4]nonan-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

1-[3-(Trifluoromethyl)pyrrolidin-3-yl]oct-7-en-1-one
CID 107010873
1-(Pyrrolidin-3-yl)pent-4-en-2-one
CID 116583305
1-[(3R)-pyrrolidin-3-yl]hex-5-en-1-one
CID 141320383
(3aR,6aR)-4-prop-2-enyl-2,3,3a,4,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-one
CID 146282535
(3aR,4S,6aR)-4-prop-2-enyl-2,3,3a,4,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-one
CID 146282543
(4S)-4-(methylaminomethyl)-2-prop-2-enylcyclopentan-1-one
CID 146282574
1-[(3S)-pyrrolidin-3-yl]pent-4-en-2-one
CID 146425669
3-Cyclopropyl-1-(3-methylpyrrolidin-3-yl)hex-5-en-2-one
CID 153378292
1-(3-Propan-2-ylpyrrolidin-3-yl)hex-5-en-1-one
CID 106982312
1-Pyrrolidin-3-yloct-7-en-1-one
CID 107010858
1-(3-Methylpyrrolidin-3-yl)oct-7-en-1-one
CID 107010863
1-(3-Ethylpyrrolidin-3-yl)oct-7-en-1-one
CID 107010864

Frequently Asked Questions

What is the IUPAC name of 7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one?
The IUPAC name of 7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one (CID 153378438) is 7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one.
What is the SMILES notation for 7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one?
The canonical SMILES for 7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one is C=CCC1CC2(CCNC2)CC1=O.
What is the InChIKey of 7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one?
The InChIKey is ANUYQINJLKWAMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-2-3-9-6-11(7-10(9)13)4-5-12-8-11/h2,9,12H,1,3-8H2.
What are the key properties of 7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one?
7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one has a molecular weight of 179.26 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-prop-2-enyl-2-azaspiro[4.4]nonan-8-one is sourced from PubChem (CID 153378438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).