3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one

C14H29N3O — CID 83237947

IUPAC3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one
SMILESCCC1(C)NC(C)N(CC(C)(C)CN(C)C)C1=O
InChIInChI=1S/C14H29N3O/c1-8-14(5)12(18)17(11(2)15-14)10-13(3,4)9-16(6)7/h11,15H,8-10H2,1-7H3
InChIKeyMSMTZHFPXHDALZ-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.52
Rot. Bonds5

About 3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one

3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one (PubChem CID 83237947) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one.

Molecular Properties

Compound Name3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one
PubChem CID83237947
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one
SMILESCCC1(C)NC(C)N(CC(C)(C)CN(C)C)C1=O
InChIInChI=1S/C14H29N3O/c1-8-14(5)12(18)17(11(2)15-14)10-13(3,4)9-16(6)7/h11,15H,8-10H2,1-7H3
InChIKeyMSMTZHFPXHDALZ-UHFFFAOYSA-N
XLogP1.52
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2,2-difluoroethyl)-5-ethyl-2,5-dimethylimidazolidin-4-one
CID 83260245
3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-methyl-2-propylimidazolidin-4-one
CID 83236696
5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one
CID 114140888
3-(2,2-dimethylpropyl)-2,5-diethyl-5-methylimidazolidin-4-one
CID 83255826
5-ethyl-2,5-dimethyl-3-(5-methylhexyl)imidazolidin-4-one
CID 83260814
5-ethyl-2,5-dimethyl-3-(2-methyl-3-pyrrolidin-1-ylpropyl)imidazolidin-4-one
CID 83254520
3-[3-(dimethylamino)-2,2-dimethylpropyl]-2-methyl-5-propan-2-ylimidazolidin-4-one
CID 83236693
3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one
CID 83250197
5-ethyl-2,5-dimethyl-3-(2-thiomorpholin-4-ylethyl)imidazolidin-4-one
CID 106327150
3-cyclopropyl-5-ethyl-2,5-dimethylimidazolidin-4-one
CID 83242982
1-(2,2-dimethylpropyl)-3-ethyl-3,6-dimethylpiperazine-2,5-dione
CID 64963887
3-[(1,4-dimethylpiperazin-2-yl)methyl]-5-ethyl-2,5-dimethylimidazolidin-4-one
CID 83264810

Frequently Asked Questions

What is the IUPAC name of 3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one?
The IUPAC name of 3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one (CID 83237947) is 3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one.
What is the SMILES notation for 3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one?
The canonical SMILES for 3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one is CCC1(C)NC(C)N(CC(C)(C)CN(C)C)C1=O.
What is the InChIKey of 3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one?
The InChIKey is MSMTZHFPXHDALZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-8-14(5)12(18)17(11(2)15-14)10-13(3,4)9-16(6)7/h11,15H,8-10H2,1-7H3.
What are the key properties of 3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one?
3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one has a molecular weight of 255.41 g/mol, XLogP of 1.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(dimethylamino)-2,2-dimethylpropyl]-5-ethyl-2,5-dimethylimidazolidin-4-one is sourced from PubChem (CID 83237947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).