5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one

C16H30N2O — CID 83270482

IUPAC5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one
SMILESCCC1NC(C)N(CC2(CC(C)C)CCCC2)C1=O
InChIInChI=1S/C16H30N2O/c1-5-14-15(19)18(13(4)17-14)11-16(10-12(2)3)8-6-7-9-16/h12-14,17H,5-11H2,1-4H3
InChIKeyHFBHMGKBWMLMNJ-UHFFFAOYSA-N
MW266.43 g/mol
LogP3.15
Rot. Bonds5

About 5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one

5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one (PubChem CID 83270482) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one
PubChem CID83270482
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one
SMILESCCC1NC(C)N(CC2(CC(C)C)CCCC2)C1=O
InChIInChI=1S/C16H30N2O/c1-5-14-15(19)18(13(4)17-14)11-16(10-12(2)3)8-6-7-9-16/h12-14,17H,5-11H2,1-4H3
InChIKeyHFBHMGKBWMLMNJ-UHFFFAOYSA-N
XLogP3.15
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one?
The IUPAC name of 5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one (CID 83270482) is 5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one.
What is the SMILES notation for 5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one?
The canonical SMILES for 5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one is CCC1NC(C)N(CC2(CC(C)C)CCCC2)C1=O.
What is the InChIKey of 5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one?
The InChIKey is HFBHMGKBWMLMNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-5-14-15(19)18(13(4)17-14)11-16(10-12(2)3)8-6-7-9-16/h12-14,17H,5-11H2,1-4H3.
What are the key properties of 5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one?
5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one has a molecular weight of 266.43 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one is sourced from PubChem (CID 83270482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).