1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one

C12H18N2O2 — CID 70569780

IUPAC1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one
SMILESO=C1NCCN1C(=O)C1CCC=CCCC1
InChIInChI=1S/C12H18N2O2/c15-11(14-9-8-13-12(14)16)10-6-4-2-1-3-5-7-10/h1-2,10H,3-9H2,(H,13,16)
InChIKeyFBWKEABNFUKXOX-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.67
Rot. Bonds1

About 1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one

1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one (PubChem CID 70569780) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one
PubChem CID70569780
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one
SMILESO=C1NCCN1C(=O)C1CCC=CCCC1
InChIInChI=1S/C12H18N2O2/c15-11(14-9-8-13-12(14)16)10-6-4-2-1-3-5-7-10/h1-2,10H,3-9H2,(H,13,16)
InChIKeyFBWKEABNFUKXOX-UHFFFAOYSA-N
XLogP1.67
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one?
The IUPAC name of 1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one (CID 70569780) is 1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one.
What is the SMILES notation for 1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one?
The canonical SMILES for 1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one is O=C1NCCN1C(=O)C1CCC=CCCC1.
What is the InChIKey of 1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one?
The InChIKey is FBWKEABNFUKXOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c15-11(14-9-8-13-12(14)16)10-6-4-2-1-3-5-7-10/h1-2,10H,3-9H2,(H,13,16).
What are the key properties of 1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one?
1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one has a molecular weight of 222.29 g/mol, XLogP of 1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclooct-4-ene-1-carbonyl)imidazolidin-2-one is sourced from PubChem (CID 70569780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).