4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one

C12H13N3O2 — CID 168664147

IUPAC4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one
SMILESO=C1CC(CO)CN1c1cccc2nccn12
InChIInChI=1S/C12H13N3O2/c16-8-9-6-12(17)15(7-9)11-3-1-2-10-13-4-5-14(10)11/h1-5,9,16H,6-8H2
InChIKeyRHUUBSXWTFTEEY-UHFFFAOYSA-N
MW231.25 g/mol
LogP0.68
Rot. Bonds2

About 4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one

4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one (PubChem CID 168664147) has the molecular formula C12H13N3O2 and a molecular weight of 231.25 g/mol. Its IUPAC name is 4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one.

Molecular Properties

Compound Name4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one
PubChem CID168664147
Molecular FormulaC12H13N3O2
Molecular Weight231.25 g/mol
Exact Mass231.10
IUPAC Name4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one
SMILESO=C1CC(CO)CN1c1cccc2nccn12
InChIInChI=1S/C12H13N3O2/c16-8-9-6-12(17)15(7-9)11-3-1-2-10-13-4-5-14(10)11/h1-5,9,16H,6-8H2
InChIKeyRHUUBSXWTFTEEY-UHFFFAOYSA-N
XLogP0.68
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-bromo-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168663841
4-(hydroxymethyl)-1-pyridazin-4-ylpyrrolidin-2-one
CID 168664190
1-(6-amino-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168664121
4-(hydroxymethyl)-1-(2-methylpyrimidin-5-yl)pyrrolidin-2-one
CID 168662722
1-(2-bromo-4-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168663955
1-(4-chloro-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168664302
1-(1,3-benzoxazol-4-yl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168664145
1-(6-bromo-3-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168663597
4-(hydroxymethyl)-1-[3-(hydroxymethyl)phenyl]pyrrolidin-2-one
CID 168664094
4-(hydroxymethyl)-1-(imidazo[1,2-a]pyridin-6-ylmethyl)pyrrolidin-2-one
CID 168663176
4-(hydroxymethyl)-1-(5-methyl-2-phenylpyrazol-3-yl)pyrrolidin-2-one
CID 168662663
4-(hydroxymethyl)-1-(4-phenylphenyl)pyrrolidin-2-one
CID 168663566

Frequently Asked Questions

What is the IUPAC name of 4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one?
The IUPAC name of 4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one (CID 168664147) is 4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one.
What is the SMILES notation for 4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one?
The canonical SMILES for 4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one is O=C1CC(CO)CN1c1cccc2nccn12.
What is the InChIKey of 4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one?
The InChIKey is RHUUBSXWTFTEEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2/c16-8-9-6-12(17)15(7-9)11-3-1-2-10-13-4-5-14(10)11/h1-5,9,16H,6-8H2.
What are the key properties of 4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one?
4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one has a molecular weight of 231.25 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(hydroxymethyl)-1-imidazo[1,2-a]pyridin-5-ylpyrrolidin-2-one is sourced from PubChem (CID 168664147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).