1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one

C13H16N2O — CID 83835905

IUPAC1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one
SMILESCC(=O)Cc1ccc2cnc(C(C)C)n2c1
InChIInChI=1S/C13H16N2O/c1-9(2)13-14-7-12-5-4-11(6-10(3)16)8-15(12)13/h4-5,7-9H,6H2,1-3H3
InChIKeyDLSMIBVEPPJNOM-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.59
Rot. Bonds3

About 1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one

1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one (PubChem CID 83835905) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one.

Molecular Properties

Compound Name1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one
PubChem CID83835905
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one
SMILESCC(=O)Cc1ccc2cnc(C(C)C)n2c1
InChIInChI=1S/C13H16N2O/c1-9(2)13-14-7-12-5-4-11(6-10(3)16)8-15(12)13/h4-5,7-9H,6H2,1-3H3
InChIKeyDLSMIBVEPPJNOM-UHFFFAOYSA-N
XLogP2.59
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Zolpidem
CID 5732
Pirmagrel
CID 55390
3-Phenylimidazo(1,5-a)pyridine
CID 606670
2-Phenylimidazo(1,2-a)pyridine
CID 201136
N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
CID 748359
3-(4-fluorophenyl)-Imidazo[1,5-a]pyridine
CID 722307
8-Methyl-2-phenylimidazo(1,2-a)pyridin-3-amine
CID 2771075
3-Phenylimidazo[1,2-a]pyridine
CID 255597
2-(6-Bromo-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-acetamide
CID 10047394
N,N-dibutyl-2-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 10361367
2-(6-Methyl-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-acetamide
CID 10498000
2-(2-Phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-acetamide
CID 10520807

Frequently Asked Questions

What is the IUPAC name of 1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one?
The IUPAC name of 1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one (CID 83835905) is 1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one.
What is the SMILES notation for 1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one?
The canonical SMILES for 1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one is CC(=O)Cc1ccc2cnc(C(C)C)n2c1.
What is the InChIKey of 1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one?
The InChIKey is DLSMIBVEPPJNOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-9(2)13-14-7-12-5-4-11(6-10(3)16)8-15(12)13/h4-5,7-9H,6H2,1-3H3.
What are the key properties of 1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one?
1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one has a molecular weight of 216.28 g/mol, XLogP of 2.59, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-propan-2-ylimidazo[1,5-a]pyridin-6-yl)propan-2-one is sourced from PubChem (CID 83835905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).