1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one

C14H16N2O — CID 83840054

IUPAC1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one
SMILESCC(=O)Cc1nc(C2CC2)n2c(C)cccc12
InChIInChI=1S/C14H16N2O/c1-9-4-3-5-13-12(8-10(2)17)15-14(16(9)13)11-6-7-11/h3-5,11H,6-8H2,1-2H3
InChIKeyJTOZCVKPKNDRMN-UHFFFAOYSA-N
MW228.29 g/mol
LogP2.65
Rot. Bonds3

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

1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one (PubChem CID 83840054) has the molecular formula C14H16N2O and a molecular weight of 228.29 g/mol. Its IUPAC name is 1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one.

Molecular Properties

Compound Name1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one
PubChem CID83840054
Molecular FormulaC14H16N2O
Molecular Weight228.29 g/mol
Exact Mass228.13
IUPAC Name1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one
SMILESCC(=O)Cc1nc(C2CC2)n2c(C)cccc12
InChIInChI=1S/C14H16N2O/c1-9-4-3-5-13-12(8-10(2)17)15-14(16(9)13)11-6-7-11/h3-5,11H,6-8H2,1-2H3
InChIKeyJTOZCVKPKNDRMN-UHFFFAOYSA-N
XLogP2.65
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one?
The IUPAC name of 1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one (CID 83840054) is 1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one.
What is the SMILES notation for 1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one?
The canonical SMILES for 1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one is CC(=O)Cc1nc(C2CC2)n2c(C)cccc12.
What is the InChIKey of 1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one?
The InChIKey is JTOZCVKPKNDRMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-9-4-3-5-13-12(8-10(2)17)15-14(16(9)13)11-6-7-11/h3-5,11H,6-8H2,1-2H3.
What are the key properties of 1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one?
1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one has a molecular weight of 228.29 g/mol, XLogP of 2.65, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopropyl-5-methylimidazo[1,5-a]pyridin-1-yl)propan-2-one is sourced from PubChem (CID 83840054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).