1-(2-methylprop-2-enyl)imidazolidin-2-one

C7H12N2O — CID 114619407

IUPAC1-(2-methylprop-2-enyl)imidazolidin-2-one
SMILESC=C(C)CN1CCNC1=O
InChIInChI=1S/C7H12N2O/c1-6(2)5-9-4-3-8-7(9)10/h1,3-5H2,2H3,(H,8,10)
InChIKeyLCOVJJBXOVMNSE-UHFFFAOYSA-N
MW140.19 g/mol
LogP0.59
Rot. Bonds2

About 1-(2-methylprop-2-enyl)imidazolidin-2-one

1-(2-methylprop-2-enyl)imidazolidin-2-one (PubChem CID 114619407) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 1-(2-methylprop-2-enyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(2-methylprop-2-enyl)imidazolidin-2-one
PubChem CID114619407
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name1-(2-methylprop-2-enyl)imidazolidin-2-one
SMILESC=C(C)CN1CCNC1=O
InChIInChI=1S/C7H12N2O/c1-6(2)5-9-4-3-8-7(9)10/h1,3-5H2,2H3,(H,8,10)
InChIKeyLCOVJJBXOVMNSE-UHFFFAOYSA-N
XLogP0.59
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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-(2-methylprop-2-enyl)imidazolidin-2-one?
The IUPAC name of 1-(2-methylprop-2-enyl)imidazolidin-2-one (CID 114619407) is 1-(2-methylprop-2-enyl)imidazolidin-2-one.
What is the SMILES notation for 1-(2-methylprop-2-enyl)imidazolidin-2-one?
The canonical SMILES for 1-(2-methylprop-2-enyl)imidazolidin-2-one is C=C(C)CN1CCNC1=O.
What is the InChIKey of 1-(2-methylprop-2-enyl)imidazolidin-2-one?
The InChIKey is LCOVJJBXOVMNSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-6(2)5-9-4-3-8-7(9)10/h1,3-5H2,2H3,(H,8,10).
What are the key properties of 1-(2-methylprop-2-enyl)imidazolidin-2-one?
1-(2-methylprop-2-enyl)imidazolidin-2-one has a molecular weight of 140.19 g/mol, XLogP of 0.59, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylprop-2-enyl)imidazolidin-2-one is sourced from PubChem (CID 114619407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).