1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one

C12H18N4O — CID 116981348

IUPAC1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one
SMILESCC(N)CN1CC(c2ccncc2)N(C)C1=O
InChIInChI=1S/C12H18N4O/c1-9(13)7-16-8-11(15(2)12(16)17)10-3-5-14-6-4-10/h3-6,9,11H,7-8,13H2,1-2H3
InChIKeyWMURGMRBJPVZHU-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.84
Rot. Bonds3

About 1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one

1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one (PubChem CID 116981348) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one.

Molecular Properties

Compound Name1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one
PubChem CID116981348
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one
SMILESCC(N)CN1CC(c2ccncc2)N(C)C1=O
InChIInChI=1S/C12H18N4O/c1-9(13)7-16-8-11(15(2)12(16)17)10-3-5-14-6-4-10/h3-6,9,11H,7-8,13H2,1-2H3
InChIKeyWMURGMRBJPVZHU-UHFFFAOYSA-N
XLogP0.84
TPSA62.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one?
The IUPAC name of 1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one (CID 116981348) is 1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one.
What is the SMILES notation for 1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one?
The canonical SMILES for 1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one is CC(N)CN1CC(c2ccncc2)N(C)C1=O.
What is the InChIKey of 1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one?
The InChIKey is WMURGMRBJPVZHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-9(13)7-16-8-11(15(2)12(16)17)10-3-5-14-6-4-10/h3-6,9,11H,7-8,13H2,1-2H3.
What are the key properties of 1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one?
1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one has a molecular weight of 234.30 g/mol, XLogP of 0.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminopropyl)-3-methyl-4-pyridin-4-ylimidazolidin-2-one is sourced from PubChem (CID 116981348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).