3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one

C13H27N3O — CID 83250197

IUPAC3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one
SMILESCCC1NC(C)(CC)C(=O)N1CC(C)N(C)C
InChIInChI=1S/C13H27N3O/c1-7-11-14-13(4,8-2)12(17)16(11)9-10(3)15(5)6/h10-11,14H,7-9H2,1-6H3
InChIKeyRVAGBKSQEQVJIQ-UHFFFAOYSA-N
MW241.38 g/mol
LogP1.27
Rot. Bonds5

About 3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one

3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one (PubChem CID 83250197) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one.

Molecular Properties

Compound Name3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one
PubChem CID83250197
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one
SMILESCCC1NC(C)(CC)C(=O)N1CC(C)N(C)C
InChIInChI=1S/C13H27N3O/c1-7-11-14-13(4,8-2)12(17)16(11)9-10(3)15(5)6/h10-11,14H,7-9H2,1-6H3
InChIKeyRVAGBKSQEQVJIQ-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

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one?
The IUPAC name of 3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one (CID 83250197) is 3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one.
What is the SMILES notation for 3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one?
The canonical SMILES for 3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one is CCC1NC(C)(CC)C(=O)N1CC(C)N(C)C.
What is the InChIKey of 3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one?
The InChIKey is RVAGBKSQEQVJIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-7-11-14-13(4,8-2)12(17)16(11)9-10(3)15(5)6/h10-11,14H,7-9H2,1-6H3.
What are the key properties of 3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one?
3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-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-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one is sourced from PubChem (CID 83250197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).