2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one

C14H28N2O — CID 114102628

IUPAC2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one
SMILESCC(C)C1NC(C)N(CC(C)(C)C(C)C)C1=O
InChIInChI=1S/C14H28N2O/c1-9(2)12-13(17)16(11(5)15-12)8-14(6,7)10(3)4/h9-12,15H,8H2,1-7H3
InChIKeyOGZICXJWOIXREA-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.47
Rot. Bonds4

About 2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one

2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one (PubChem CID 114102628) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one
PubChem CID114102628
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one
SMILESCC(C)C1NC(C)N(CC(C)(C)C(C)C)C1=O
InChIInChI=1S/C14H28N2O/c1-9(2)12-13(17)16(11(5)15-12)8-14(6,7)10(3)4/h9-12,15H,8H2,1-7H3
InChIKeyOGZICXJWOIXREA-UHFFFAOYSA-N
XLogP2.47
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one
CID 114102621
3-[3-(dimethylamino)-2,2-dimethylpropyl]-2-methyl-5-propan-2-ylimidazolidin-4-one
CID 83236693
3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one
CID 83256296
3-decyl-2-methyl-5-propan-2-ylimidazolidin-4-one
CID 83270397
2-methyl-3-(oxan-2-ylmethyl)-5-propan-2-ylimidazolidin-4-one
CID 83256490
3-(2,2-dimethylpropyl)-2,5-dimethylimidazolidin-4-one
CID 83256720
5-butan-2-yl-3-(2,3-dimethylbutyl)-2-methylimidazolidin-4-one
CID 83259137
5-butan-2-yl-2-methyl-3-(4,4,4-trifluorobutyl)imidazolidin-4-one
CID 83259869
3-(2-methoxy-2-methylpropyl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
CID 104767800
2-methyl-3-(6-methylheptan-2-yl)-5-propan-2-ylimidazolidin-4-one
CID 83252163
2-methyl-3-(2-methylcyclopropyl)-5-propan-2-ylimidazolidin-4-one
CID 83255411
5-butan-2-yl-3-[2-(diethylamino)ethyl]-2-methylimidazolidin-4-one
CID 83239751

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one?
The IUPAC name of 2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one (CID 114102628) is 2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one.
What is the SMILES notation for 2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one?
The canonical SMILES for 2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one is CC(C)C1NC(C)N(CC(C)(C)C(C)C)C1=O.
What is the InChIKey of 2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one?
The InChIKey is OGZICXJWOIXREA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-9(2)12-13(17)16(11(5)15-12)8-14(6,7)10(3)4/h9-12,15H,8H2,1-7H3.
What are the key properties of 2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one?
2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one has a molecular weight of 240.39 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one is sourced from PubChem (CID 114102628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).