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

C15H28N2O — CID 113464309

IUPAC3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
SMILESCC(C)CC1NC(C(C)C)N(CC2CC2C)C1=O
InChIInChI=1S/C15H28N2O/c1-9(2)6-13-15(18)17(8-12-7-11(12)5)14(16-13)10(3)4/h9-14,16H,6-8H2,1-5H3
InChIKeySAUGQIFVVNQSPA-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.47
Rot. Bonds5

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

3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one (PubChem CID 113464309) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
PubChem CID113464309
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
SMILESCC(C)CC1NC(C(C)C)N(CC2CC2C)C1=O
InChIInChI=1S/C15H28N2O/c1-9(2)6-13-15(18)17(8-12-7-11(12)5)14(16-13)10(3)4/h9-14,16H,6-8H2,1-5H3
InChIKeySAUGQIFVVNQSPA-UHFFFAOYSA-N
XLogP2.47
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(2-methylcyclopentyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 107421415
5-(2-methylpropyl)-3-(2-methylsulfinylethyl)-2-propan-2-ylimidazolidin-4-one
CID 113480746
3-(3-methoxypropyl)-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 83243563
3-(1-cyclopropylbutan-2-yl)-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 83263401
5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one
CID 83256159
3-(3-methylpentan-2-yl)-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 83246568
5-ethyl-3-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 83242217
3-[(3-methoxyoxolan-3-yl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 104767840
6-ethyl-1-[(2-methylcyclopropyl)methyl]-3-propan-2-ylpiperazine-2,5-dione
CID 113464219
3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83243576
2-methyl-5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one
CID 83257702
2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83254538

Frequently Asked Questions

What is the IUPAC name of 3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one?
The IUPAC name of 3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one (CID 113464309) is 3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one is CC(C)CC1NC(C(C)C)N(CC2CC2C)C1=O.
What is the InChIKey of 3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one?
The InChIKey is SAUGQIFVVNQSPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-9(2)6-13-15(18)17(8-12-7-11(12)5)14(16-13)10(3)4/h9-14,16H,6-8H2,1-5H3.
What are the key properties of 3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one?
3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one has a molecular weight of 252.40 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 113464309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).