3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one

C13H24N2O2 — CID 83270720

IUPAC3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one
SMILESCC(C)CC1NCN(CC2(C)CCCO2)C1=O
InChIInChI=1S/C13H24N2O2/c1-10(2)7-11-12(16)15(9-14-11)8-13(3)5-4-6-17-13/h10-11,14H,4-9H2,1-3H3
InChIKeyUIXQLSXHFFDLGC-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.36
Rot. Bonds4

About 3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one

3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one (PubChem CID 83270720) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one.

Molecular Properties

Compound Name3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one
PubChem CID83270720
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one
SMILESCC(C)CC1NCN(CC2(C)CCCO2)C1=O
InChIInChI=1S/C13H24N2O2/c1-10(2)7-11-12(16)15(9-14-11)8-13(3)5-4-6-17-13/h10-11,14H,4-9H2,1-3H3
InChIKeyUIXQLSXHFFDLGC-UHFFFAOYSA-N
XLogP1.36
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-butyl-3-[(2-methyloxolan-2-yl)methyl]imidazolidin-4-one
CID 83270798
5-butan-2-yl-3-[(2-methyloxolan-2-yl)methyl]imidazolidin-4-one
CID 83270878
5-ethyl-3-[(2-methyloxolan-2-yl)methyl]-2-(2-methylpropyl)imidazolidin-4-one
CID 83271120
5-(2-methylpropyl)-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one
CID 83258955
3-(3-methylbutyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83238290
5-(2-methylpropyl)-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one
CID 83253267
5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one
CID 83257953
3-(2-methyl-3-methylsulfanylpropyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83257472
3-[2-(dimethylamino)-2-methylpropyl]-5-(2-methylpropyl)imidazolidin-4-one
CID 83253023
3-(2-methoxy-2-methylpropyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 104767754
3-[(1,1-dioxothiolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one
CID 83270602
5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one
CID 103968852

Frequently Asked Questions

What is the IUPAC name of 3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one?
The IUPAC name of 3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one (CID 83270720) is 3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one.
What is the SMILES notation for 3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one?
The canonical SMILES for 3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one is CC(C)CC1NCN(CC2(C)CCCO2)C1=O.
What is the InChIKey of 3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one?
The InChIKey is UIXQLSXHFFDLGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-10(2)7-11-12(16)15(9-14-11)8-13(3)5-4-6-17-13/h10-11,14H,4-9H2,1-3H3.
What are the key properties of 3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one?
3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one has a molecular weight of 240.35 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one is sourced from PubChem (CID 83270720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).