1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one

C14H18N4O — CID 15952555

IUPAC1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one
SMILESCCCC1CC(=O)N(Cc2cnc3ncccn23)C1
InChIInChI=1S/C14H18N4O/c1-2-4-11-7-13(19)17(9-11)10-12-8-16-14-15-5-3-6-18(12)14/h3,5-6,8,11H,2,4,7,9-10H2,1H3
InChIKeyLJTRTVWEDDKARB-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.88
Rot. Bonds4

About 1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one

1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one (PubChem CID 15952555) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one.

Molecular Properties

Compound Name1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one
PubChem CID15952555
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one
SMILESCCCC1CC(=O)N(Cc2cnc3ncccn23)C1
InChIInChI=1S/C14H18N4O/c1-2-4-11-7-13(19)17(9-11)10-12-8-16-14-15-5-3-6-18(12)14/h3,5-6,8,11H,2,4,7,9-10H2,1H3
InChIKeyLJTRTVWEDDKARB-UHFFFAOYSA-N
XLogP1.88
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-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-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one?
The IUPAC name of 1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one (CID 15952555) is 1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one.
What is the SMILES notation for 1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one?
The canonical SMILES for 1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one is CCCC1CC(=O)N(Cc2cnc3ncccn23)C1.
What is the InChIKey of 1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one?
The InChIKey is LJTRTVWEDDKARB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-2-4-11-7-13(19)17(9-11)10-12-8-16-14-15-5-3-6-18(12)14/h3,5-6,8,11H,2,4,7,9-10H2,1H3.
What are the key properties of 1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one?
1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one has a molecular weight of 258.32 g/mol, XLogP of 1.88, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(imidazo[1,2-a]pyrimidin-3-ylmethyl)-4-propylpyrrolidin-2-one is sourced from PubChem (CID 15952555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).