5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one

C15H31N3O — CID 83253081

IUPAC5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one
SMILESCCC1NC(CC(C)C)N(CCN(C)C(C)C)C1=O
InChIInChI=1S/C15H31N3O/c1-7-13-15(19)18(9-8-17(6)12(4)5)14(16-13)10-11(2)3/h11-14,16H,7-10H2,1-6H3
InChIKeyHOGJLYRPWDVOEG-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.91
Rot. Bonds7

About 5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one

5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one (PubChem CID 83253081) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one
PubChem CID83253081
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one
SMILESCCC1NC(CC(C)C)N(CCN(C)C(C)C)C1=O
InChIInChI=1S/C15H31N3O/c1-7-13-15(19)18(9-8-17(6)12(4)5)14(16-13)10-11(2)3/h11-14,16H,7-10H2,1-6H3
InChIKeyHOGJLYRPWDVOEG-UHFFFAOYSA-N
XLogP1.91
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one?
The IUPAC name of 5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one (CID 83253081) is 5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one.
What is the SMILES notation for 5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one?
The canonical SMILES for 5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one is CCC1NC(CC(C)C)N(CCN(C)C(C)C)C1=O.
What is the InChIKey of 5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one?
The InChIKey is HOGJLYRPWDVOEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-7-13-15(19)18(9-8-17(6)12(4)5)14(16-13)10-11(2)3/h11-14,16H,7-10H2,1-6H3.
What are the key properties of 5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one?
5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one has a molecular weight of 269.43 g/mol, XLogP of 1.91, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one is sourced from PubChem (CID 83253081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).