3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one

C17H32N2O — CID 107421415

IUPAC3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
SMILESCC(C)CC1NC(C(C)C)N(CC2CCCC2C)C1=O
InChIInChI=1S/C17H32N2O/c1-11(2)9-15-17(20)19(16(18-15)12(3)4)10-14-8-6-7-13(14)5/h11-16,18H,6-10H2,1-5H3
InChIKeyAQFPUASWXUOTTM-UHFFFAOYSA-N
MW280.46 g/mol
LogP3.25
Rot. Bonds5

About 3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one

3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one (PubChem CID 107421415) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
PubChem CID107421415
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
SMILESCC(C)CC1NC(C(C)C)N(CC2CCCC2C)C1=O
InChIInChI=1S/C17H32N2O/c1-11(2)9-15-17(20)19(16(18-15)12(3)4)10-14-8-6-7-13(14)5/h11-16,18H,6-10H2,1-5H3
InChIKeyAQFPUASWXUOTTM-UHFFFAOYSA-N
XLogP3.25
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 113464309
5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one
CID 83256159
1-[(2-methylcyclopentyl)methyl]-3-(2-methylpropyl)piperazine-2,5-dione
CID 107420963
3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83243576
3-(1-cyclopropylbutan-2-yl)-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 83263401
3-[(2-methylcyclopentyl)methyl]-2,5-dipropylimidazolidin-4-one
CID 107421422
5-(2-methylpropyl)-3-(2-methylsulfinylethyl)-2-propan-2-ylimidazolidin-4-one
CID 113480746
5-butyl-3-(cyclobutylmethyl)-2-propan-2-ylimidazolidin-4-one
CID 83244060
3-[(2-methylcyclopentyl)methyl]-2-(2-methylpropyl)-1,3-diazaspiro[4.4]nonan-4-one
CID 107421436
3-(3-methoxypropyl)-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 83243563
6-ethyl-1-[(2-methylcyclohexyl)methyl]-3-propan-2-ylpiperazine-2,5-dione
CID 64967164
2-cyclopentyl-5-methyl-3-[(2-methylcyclopentyl)methyl]imidazolidin-4-one
CID 107421438

Frequently Asked Questions

What is the IUPAC name of 3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one?
The IUPAC name of 3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one (CID 107421415) is 3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one is CC(C)CC1NC(C(C)C)N(CC2CCCC2C)C1=O.
What is the InChIKey of 3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one?
The InChIKey is AQFPUASWXUOTTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-11(2)9-15-17(20)19(16(18-15)12(3)4)10-14-8-6-7-13(14)5/h11-16,18H,6-10H2,1-5H3.
What are the key properties of 3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one?
3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one has a molecular weight of 280.46 g/mol, XLogP of 3.25, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 107421415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).