3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one

C13H27N3O — CID 83236812

IUPAC3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one
SMILESCC1NC(C)N(CCN(C(C)C)C(C)C)C1=O
InChIInChI=1S/C13H27N3O/c1-9(2)15(10(3)4)7-8-16-12(6)14-11(5)13(16)17/h9-12,14H,7-8H2,1-6H3
InChIKeyRNWDGYCITPACDA-UHFFFAOYSA-N
MW241.38 g/mol
LogP1.27
Rot. Bonds5

About 3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one

3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one (PubChem CID 83236812) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one.

Molecular Properties

Compound Name3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one
PubChem CID83236812
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one
SMILESCC1NC(C)N(CCN(C(C)C)C(C)C)C1=O
InChIInChI=1S/C13H27N3O/c1-9(2)15(10(3)4)7-8-16-12(6)14-11(5)13(16)17/h9-12,14H,7-8H2,1-6H3
InChIKeyRNWDGYCITPACDA-UHFFFAOYSA-N
XLogP1.27
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,5-dimethyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
CID 83250601
3-[2-(dimethylamino)ethyl]-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
CID 83251594
3-(2,2-dimethylpropyl)-2,5-dimethylimidazolidin-4-one
CID 83256720
5-butan-2-yl-3-[2-(diethylamino)ethyl]-2-methylimidazolidin-4-one
CID 83239751
2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one
CID 83248889
2-methyl-3-[3-[methyl(propan-2-yl)amino]propyl]-5-(2-methylpropyl)imidazolidin-4-one
CID 106053028
5-ethyl-2-methyl-3-[4-[methyl(propan-2-yl)amino]butyl]imidazolidin-4-one
CID 83248231
5-methyl-2-propan-2-yl-3-propylimidazolidin-4-one
CID 83243212
3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one
CID 83251966
3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
CID 83250403
3-[2-[di(propan-2-yl)amino]ethyl]-5-ethylimidazolidin-4-one
CID 83237576
1-[2-[di(propan-2-yl)amino]ethyl]imidazolidin-2-one
CID 115370405

Frequently Asked Questions

What is the IUPAC name of 3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one?
The IUPAC name of 3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one (CID 83236812) is 3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one.
What is the SMILES notation for 3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one?
The canonical SMILES for 3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one is CC1NC(C)N(CCN(C(C)C)C(C)C)C1=O.
What is the InChIKey of 3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one?
The InChIKey is RNWDGYCITPACDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-9(2)15(10(3)4)7-8-16-12(6)14-11(5)13(16)17/h9-12,14H,7-8H2,1-6H3.
What are the key properties of 3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one?
3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one has a molecular weight of 241.38 g/mol, XLogP of 1.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one is sourced from PubChem (CID 83236812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).