4-ethyl-5-imino-1-methylimidazolidin-2-one

C6H11N3O — CID 148999775

IUPAC4-ethyl-5-imino-1-methylimidazolidin-2-one
SMILES[H]/N=C1/C(CC)NC(=O)N1C
InChIInChI=1S/C6H11N3O/c1-3-4-5(7)9(2)6(10)8-4/h4,7H,3H2,1-2H3,(H,8,10)/b7-5-
InChIKeyPZKONKSVHREBCC-ALCCZGGFSA-N
MW141.17 g/mol
LogP0.40
Rot. Bonds1

About 4-ethyl-5-imino-1-methylimidazolidin-2-one

4-ethyl-5-imino-1-methylimidazolidin-2-one (PubChem CID 148999775) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is 4-ethyl-5-imino-1-methylimidazolidin-2-one.

Molecular Properties

Compound Name4-ethyl-5-imino-1-methylimidazolidin-2-one
PubChem CID148999775
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC Name4-ethyl-5-imino-1-methylimidazolidin-2-one
SMILES[H]/N=C1/C(CC)NC(=O)N1C
InChIInChI=1S/C6H11N3O/c1-3-4-5(7)9(2)6(10)8-4/h4,7H,3H2,1-2H3,(H,8,10)/b7-5-
InChIKeyPZKONKSVHREBCC-ALCCZGGFSA-N
XLogP0.40
TPSA56.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3,5-Dimethylimidazolidin-4-imine
CID 89073031
1-[(3R)-1-carbamimidoylpyrrolidin-3-yl]-3-methylurea
CID 89495141
4-amino-5-methyl-2,5-dihydro-1H-imidazol-2-one
CID 137701550
4-Imino-5-propan-2-ylimidazolidin-2-one
CID 138388222
4-Ethyl-5-iminoimidazolidin-2-one
CID 138388729
Ethane;4-imino-1-methylimidazolidin-2-one
CID 142360748
N-ethyl-2-iminopyrrolidine-1-carboxamide
CID 143847890
Ethane;1-ethyl-4-imino-3,5-dimethylimidazolidin-2-one
CID 156893057
1-Ethyl-4-imino-3,5-dimethylimidazolidin-2-one
CID 156893058
1,3-Diethyl-4-imino-5-methylimidazolidin-2-one
CID 156893632
Ethane;4-imino-5-methyl-1,3-dipropylimidazolidin-2-one
CID 156894013
4-Imino-5-methyl-1,3-dipropylimidazolidin-2-one
CID 156894014

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-imino-1-methylimidazolidin-2-one?
The IUPAC name of 4-ethyl-5-imino-1-methylimidazolidin-2-one (CID 148999775) is 4-ethyl-5-imino-1-methylimidazolidin-2-one.
What is the SMILES notation for 4-ethyl-5-imino-1-methylimidazolidin-2-one?
The canonical SMILES for 4-ethyl-5-imino-1-methylimidazolidin-2-one is [H]/N=C1/C(CC)NC(=O)N1C.
What is the InChIKey of 4-ethyl-5-imino-1-methylimidazolidin-2-one?
The InChIKey is PZKONKSVHREBCC-ALCCZGGFSA-N. The full InChI is InChI=1S/C6H11N3O/c1-3-4-5(7)9(2)6(10)8-4/h4,7H,3H2,1-2H3,(H,8,10)/b7-5-.
What are the key properties of 4-ethyl-5-imino-1-methylimidazolidin-2-one?
4-ethyl-5-imino-1-methylimidazolidin-2-one has a molecular weight of 141.17 g/mol, XLogP of 0.40, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-imino-1-methylimidazolidin-2-one is sourced from PubChem (CID 148999775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).