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

C11H16N2O2 — CID 70570251

IUPAC1-(cyclohept-4-ene-1-carbonyl)imidazolidin-2-one
SMILESO=C1NCCN1C(=O)C1CCC=CCC1
InChIInChI=1S/C11H16N2O2/c14-10(13-8-7-12-11(13)15)9-5-3-1-2-4-6-9/h1-2,9H,3-8H2,(H,12,15)
InChIKeyXVMUROOYYKRGDR-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.28
Rot. Bonds1

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

1-(cyclohept-4-ene-1-carbonyl)imidazolidin-2-one (PubChem CID 70570251) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-(cyclohept-4-ene-1-carbonyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(cyclohept-4-ene-1-carbonyl)imidazolidin-2-one
PubChem CID70570251
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name1-(cyclohept-4-ene-1-carbonyl)imidazolidin-2-one
SMILESO=C1NCCN1C(=O)C1CCC=CCC1
InChIInChI=1S/C11H16N2O2/c14-10(13-8-7-12-11(13)15)9-5-3-1-2-4-6-9/h1-2,9H,3-8H2,(H,12,15)
InChIKeyXVMUROOYYKRGDR-UHFFFAOYSA-N
XLogP1.28
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclohept-4-ene-1-carbonyl)imidazolidin-2-one?
The IUPAC name of 1-(cyclohept-4-ene-1-carbonyl)imidazolidin-2-one (CID 70570251) is 1-(cyclohept-4-ene-1-carbonyl)imidazolidin-2-one.
What is the SMILES notation for 1-(cyclohept-4-ene-1-carbonyl)imidazolidin-2-one?
The canonical SMILES for 1-(cyclohept-4-ene-1-carbonyl)imidazolidin-2-one is O=C1NCCN1C(=O)C1CCC=CCC1.
What is the InChIKey of 1-(cyclohept-4-ene-1-carbonyl)imidazolidin-2-one?
The InChIKey is XVMUROOYYKRGDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c14-10(13-8-7-12-11(13)15)9-5-3-1-2-4-6-9/h1-2,9H,3-8H2,(H,12,15).
What are the key properties of 1-(cyclohept-4-ene-1-carbonyl)imidazolidin-2-one?
1-(cyclohept-4-ene-1-carbonyl)imidazolidin-2-one has a molecular weight of 208.26 g/mol, XLogP of 1.28, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohept-4-ene-1-carbonyl)imidazolidin-2-one is sourced from PubChem (CID 70570251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).