5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one

C13H24N2O — CID 83259949

IUPAC5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one
SMILESCC1NCN(C2CCCCC2C(C)C)C1=O
InChIInChI=1S/C13H24N2O/c1-9(2)11-6-4-5-7-12(11)15-8-14-10(3)13(15)16/h9-12,14H,4-8H2,1-3H3
InChIKeyMENYNIAKKPHJKK-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.98
Rot. Bonds2

About 5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one

5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one (PubChem CID 83259949) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one
PubChem CID83259949
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one
SMILESCC1NCN(C2CCCCC2C(C)C)C1=O
InChIInChI=1S/C13H24N2O/c1-9(2)11-6-4-5-7-12(11)15-8-14-10(3)13(15)16/h9-12,14H,4-8H2,1-3H3
InChIKeyMENYNIAKKPHJKK-UHFFFAOYSA-N
XLogP1.98
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclohexyl-5-methylimidazolidin-4-one
CID 83242864
5-methyl-3-(1-methylpiperidin-4-yl)imidazolidin-4-one
CID 83244069
5-methyl-3-(oxan-4-yl)imidazolidin-4-one
CID 83244206
3-(3,4-dimethylcyclohexyl)-5-methylimidazolidin-4-one
CID 83264832
3-(1,1-dioxothian-4-yl)-5-methylimidazolidin-4-one
CID 83243464
3-(3,3-dimethylcyclopentyl)-5-methylimidazolidin-4-one
CID 114552415
3-(2,2-dimethyloxolan-3-yl)-5-methylimidazolidin-4-one
CID 130709273
(5S)-3,5-dimethylimidazolidin-4-one
CID 12794136
(7R,8R)-7-propan-2-yl-1,2,5,6,7,8-hexahydropyrrolizin-3-one
CID 45096358
5-methyl-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one
CID 83244374
1-cyclobutyl-3-methylpiperazin-2-one
CID 115101959
3-(2-methylcycloheptyl)-5-propylimidazolidin-4-one
CID 83258446

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one?
The IUPAC name of 5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one (CID 83259949) is 5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one.
What is the SMILES notation for 5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one?
The canonical SMILES for 5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one is CC1NCN(C2CCCCC2C(C)C)C1=O.
What is the InChIKey of 5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one?
The InChIKey is MENYNIAKKPHJKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-9(2)11-6-4-5-7-12(11)15-8-14-10(3)13(15)16/h9-12,14H,4-8H2,1-3H3.
What are the key properties of 5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one?
5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one has a molecular weight of 224.35 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-(2-propan-2-ylcyclohexyl)imidazolidin-4-one is sourced from PubChem (CID 83259949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).