5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one

C10H19N3O — CID 138388406

IUPAC5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one
SMILES[H]/N=C1\NC(=O)N(CC(C)C)C1(C)CC
InChIInChI=1S/C10H19N3O/c1-5-10(4)8(11)12-9(14)13(10)6-7(2)3/h7H,5-6H2,1-4H3,(H2,11,12,14)
InChIKeyVHJBKQFKLSRFGP-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.81
Rot. Bonds3

About 5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one

5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one (PubChem CID 138388406) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one.

Molecular Properties

Compound Name5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one
PubChem CID138388406
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one
SMILES[H]/N=C1\NC(=O)N(CC(C)C)C1(C)CC
InChIInChI=1S/C10H19N3O/c1-5-10(4)8(11)12-9(14)13(10)6-7(2)3/h7H,5-6H2,1-4H3,(H2,11,12,14)
InChIKeyVHJBKQFKLSRFGP-UHFFFAOYSA-N
XLogP1.81
TPSA56.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one?
The IUPAC name of 5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one (CID 138388406) is 5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one.
What is the SMILES notation for 5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one?
The canonical SMILES for 5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one is [H]/N=C1\NC(=O)N(CC(C)C)C1(C)CC.
What is the InChIKey of 5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one?
The InChIKey is VHJBKQFKLSRFGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-5-10(4)8(11)12-9(14)13(10)6-7(2)3/h7H,5-6H2,1-4H3,(H2,11,12,14).
What are the key properties of 5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one?
5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one has a molecular weight of 197.28 g/mol, XLogP of 1.81, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-imino-5-methyl-1-(2-methylpropyl)imidazolidin-2-one is sourced from PubChem (CID 138388406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).