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

C15H28N2O — CID 83256159

IUPAC5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one
SMILESCC1NC(C(C)C)N(CC2CCCCC2C)C1=O
InChIInChI=1S/C15H28N2O/c1-10(2)14-16-12(4)15(18)17(14)9-13-8-6-5-7-11(13)3/h10-14,16H,5-9H2,1-4H3
InChIKeyPOTXAYINICUZPE-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.62
Rot. Bonds3

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

5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one (PubChem CID 83256159) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one
PubChem CID83256159
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one
SMILESCC1NC(C(C)C)N(CC2CCCCC2C)C1=O
InChIInChI=1S/C15H28N2O/c1-10(2)14-16-12(4)15(18)17(14)9-13-8-6-5-7-11(13)3/h10-14,16H,5-9H2,1-4H3
InChIKeyPOTXAYINICUZPE-UHFFFAOYSA-N
XLogP2.62
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.62
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
2-cyclopentyl-5-methyl-3-[(2-methylcyclopentyl)methyl]imidazolidin-4-one
CID 107421438
6-ethyl-1-[(2-methylcyclohexyl)methyl]-3-propan-2-ylpiperazine-2,5-dione
CID 64967164
3-[(2-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83256565
5-methyl-2-propan-2-yl-3-propylimidazolidin-4-one
CID 83243212
3-(2,2-dimethylpropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one
CID 83255750
3-[(2-methylcyclopropyl)methyl]-5-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 113464309
3-cyclopropyl-6-methyl-1-[(2-methylcyclohexyl)methyl]piperazine-2,5-dione
CID 64967234
3-(1-cyclohexylethyl)-5-methyl-2-propan-2-ylimidazolidin-4-one
CID 83255331
5-ethyl-3-(2-methylcyclohexyl)-2-propan-2-ylimidazolidin-4-one
CID 83238642
3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83243576
3-[(2-methylcyclopentyl)methyl]-2,5-dipropylimidazolidin-4-one
CID 107421422

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one?
The IUPAC name of 5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one (CID 83256159) is 5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one is CC1NC(C(C)C)N(CC2CCCCC2C)C1=O.
What is the InChIKey of 5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one?
The InChIKey is POTXAYINICUZPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-10(2)14-16-12(4)15(18)17(14)9-13-8-6-5-7-11(13)3/h10-14,16H,5-9H2,1-4H3.
What are the key properties of 5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one?
5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one has a molecular weight of 252.40 g/mol, XLogP of 2.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 83256159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).