3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one

C18H34N2O — CID 83262725

IUPAC3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one
SMILESCC(C)CC1NC(CC(C)C)N(CC2(C)CCCC2)C1=O
InChIInChI=1S/C18H34N2O/c1-13(2)10-15-17(21)20(16(19-15)11-14(3)4)12-18(5)8-6-7-9-18/h13-16,19H,6-12H2,1-5H3
InChIKeyXRFOSGQLLFMEJM-UHFFFAOYSA-N
MW294.48 g/mol
LogP3.79
Rot. Bonds6

About 3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one

3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one (PubChem CID 83262725) has the molecular formula C18H34N2O and a molecular weight of 294.48 g/mol. Its IUPAC name is 3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one.

Molecular Properties

Compound Name3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one
PubChem CID83262725
Molecular FormulaC18H34N2O
Molecular Weight294.48 g/mol
Exact Mass294.27
IUPAC Name3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one
SMILESCC(C)CC1NC(CC(C)C)N(CC2(C)CCCC2)C1=O
InChIInChI=1S/C18H34N2O/c1-13(2)10-15-17(21)20(16(19-15)11-14(3)4)12-18(5)8-6-7-9-18/h13-16,19H,6-12H2,1-5H3
InChIKeyXRFOSGQLLFMEJM-UHFFFAOYSA-N
XLogP3.79
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.48
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-bis(2-methylpropyl)-3-[(2-methylthiolan-2-yl)methyl]imidazolidin-4-one
CID 83268307
6-methyl-1-[(1-methylcyclopentyl)methyl]-3-(2-methylpropyl)piperazine-2,5-dione
CID 64971117
6-[(1-methylcyclopentyl)methyl]-5-(2-methylpropyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83257010
5-ethyl-3-[(2-methyloxolan-2-yl)methyl]-2-(2-methylpropyl)imidazolidin-4-one
CID 83271120
3-(4-methylpentyl)-2,5-bis(2-methylpropyl)imidazolidin-4-one
CID 83254863
2-(2-methylpropyl)-3-[(2-methylthiolan-2-yl)methyl]-5-propylimidazolidin-4-one
CID 83270568
3-[[1-(dimethylamino)cyclobutyl]methyl]-2-(2-methylpropyl)-5-propylimidazolidin-4-one
CID 105421083
3-(2,2-dimethylpropyl)-2,5-bis(2-methylpropyl)imidazolidin-4-one
CID 83255978
3-(2-methoxy-2-methylpropyl)-2,5-bis(2-methylpropyl)imidazolidin-4-one
CID 104767759
actinium;(2R,5S)-3-hydroxy-2,5-bis(2-methylpropyl)imidazolidin-4-one
CID 59884006
2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one
CID 114117454
3-[(1,4-dimethylpiperidin-4-yl)methyl]-2,5-diethylimidazolidin-4-one
CID 107165674

Frequently Asked Questions

What is the IUPAC name of 3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one?
The IUPAC name of 3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one (CID 83262725) is 3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one.
What is the SMILES notation for 3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one?
The canonical SMILES for 3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one is CC(C)CC1NC(CC(C)C)N(CC2(C)CCCC2)C1=O.
What is the InChIKey of 3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one?
The InChIKey is XRFOSGQLLFMEJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O/c1-13(2)10-15-17(21)20(16(19-15)11-14(3)4)12-18(5)8-6-7-9-18/h13-16,19H,6-12H2,1-5H3.
What are the key properties of 3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one?
3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one has a molecular weight of 294.48 g/mol, XLogP of 3.79, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one is sourced from PubChem (CID 83262725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).