2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one

C18H32N2O — CID 83262733

IUPAC2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one
SMILESCCCC1NC(C2CCCC2)N(CC2(C)CCCC2)C1=O
InChIInChI=1S/C18H32N2O/c1-3-8-15-17(21)20(13-18(2)11-6-7-12-18)16(19-15)14-9-4-5-10-14/h14-16,19H,3-13H2,1-2H3
InChIKeyNPAONGDWCNDBAR-UHFFFAOYSA-N
MW292.47 g/mol
LogP3.68
Rot. Bonds5

About 2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one

2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one (PubChem CID 83262733) has the molecular formula C18H32N2O and a molecular weight of 292.47 g/mol. Its IUPAC name is 2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one.

Molecular Properties

Compound Name2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one
PubChem CID83262733
Molecular FormulaC18H32N2O
Molecular Weight292.47 g/mol
Exact Mass292.25
IUPAC Name2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one
SMILESCCCC1NC(C2CCCC2)N(CC2(C)CCCC2)C1=O
InChIInChI=1S/C18H32N2O/c1-3-8-15-17(21)20(13-18(2)11-6-7-12-18)16(19-15)14-9-4-5-10-14/h14-16,19H,3-13H2,1-2H3
InChIKeyNPAONGDWCNDBAR-UHFFFAOYSA-N
XLogP3.68
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one?
The IUPAC name of 2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one (CID 83262733) is 2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one.
What is the SMILES notation for 2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one?
The canonical SMILES for 2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one is CCCC1NC(C2CCCC2)N(CC2(C)CCCC2)C1=O.
What is the InChIKey of 2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one?
The InChIKey is NPAONGDWCNDBAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O/c1-3-8-15-17(21)20(13-18(2)11-6-7-12-18)16(19-15)14-9-4-5-10-14/h14-16,19H,3-13H2,1-2H3.
What are the key properties of 2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one?
2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one has a molecular weight of 292.47 g/mol, XLogP of 3.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one is sourced from PubChem (CID 83262733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).