3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one

C13H24N2O — CID 83259486

IUPAC3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one
SMILESCCC1NC(C)C(=O)N1C1CCC(C)C1C
InChIInChI=1S/C13H24N2O/c1-5-12-14-10(4)13(16)15(12)11-7-6-8(2)9(11)3/h8-12,14H,5-7H2,1-4H3
InChIKeyADPNRTPOVNIEAN-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.98
Rot. Bonds2

About 3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one

3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one (PubChem CID 83259486) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one
PubChem CID83259486
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one
SMILESCCC1NC(C)C(=O)N1C1CCC(C)C1C
InChIInChI=1S/C13H24N2O/c1-5-12-14-10(4)13(16)15(12)11-7-6-8(2)9(11)3/h8-12,14H,5-7H2,1-4H3
InChIKeyADPNRTPOVNIEAN-UHFFFAOYSA-N
XLogP1.98
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one?
The IUPAC name of 3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one (CID 83259486) is 3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one.
What is the SMILES notation for 3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one?
The canonical SMILES for 3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one is CCC1NC(C)C(=O)N1C1CCC(C)C1C.
What is the InChIKey of 3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one?
The InChIKey is ADPNRTPOVNIEAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-5-12-14-10(4)13(16)15(12)11-7-6-8(2)9(11)3/h8-12,14H,5-7H2,1-4H3.
What are the key properties of 3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one?
3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one has a molecular weight of 224.35 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylimidazolidin-4-one is sourced from PubChem (CID 83259486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).