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

C13H14N2O — CID 83835502

IUPAC1-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)propan-2-one
SMILESCC(=O)Cc1ccc2cnc(C3CC3)n2c1
InChIInChI=1S/C13H14N2O/c1-9(16)6-10-2-5-12-7-14-13(11-3-4-11)15(12)8-10/h2,5,7-8,11H,3-4,6H2,1H3
InChIKeyMUJCOOLBBZRKPE-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.34
Rot. Bonds3

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

1-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)propan-2-one (PubChem CID 83835502) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 1-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)propan-2-one.

Molecular Properties

Compound Name1-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)propan-2-one
PubChem CID83835502
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name1-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)propan-2-one
SMILESCC(=O)Cc1ccc2cnc(C3CC3)n2c1
InChIInChI=1S/C13H14N2O/c1-9(16)6-10-2-5-12-7-14-13(11-3-4-11)15(12)8-10/h2,5,7-8,11H,3-4,6H2,1H3
InChIKeyMUJCOOLBBZRKPE-UHFFFAOYSA-N
XLogP2.34
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)propan-2-one?
The IUPAC name of 1-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)propan-2-one (CID 83835502) is 1-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)propan-2-one.
What is the SMILES notation for 1-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)propan-2-one?
The canonical SMILES for 1-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)propan-2-one is CC(=O)Cc1ccc2cnc(C3CC3)n2c1.
What is the InChIKey of 1-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)propan-2-one?
The InChIKey is MUJCOOLBBZRKPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-9(16)6-10-2-5-12-7-14-13(11-3-4-11)15(12)8-10/h2,5,7-8,11H,3-4,6H2,1H3.
What are the key properties of 1-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)propan-2-one?
1-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)propan-2-one has a molecular weight of 214.27 g/mol, XLogP of 2.34, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopropylimidazo[1,5-a]pyridin-6-yl)propan-2-one is sourced from PubChem (CID 83835502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).