2-imidazo[1,5-a]pyridin-7-ylacetic acid

C9H8N2O2 — CID 83827565

IUPAC2-imidazo[1,5-a]pyridin-7-ylacetic acid
SMILESO=C(O)Cc1ccn2cncc2c1
InChIInChI=1S/C9H8N2O2/c12-9(13)4-7-1-2-11-6-10-5-8(11)3-7/h1-3,5-6H,4H2,(H,12,13)
InChIKeyBFPHCNALFGRYJJ-UHFFFAOYSA-N
MW176.17 g/mol
LogP0.96
Rot. Bonds2

About 2-imidazo[1,5-a]pyridin-7-ylacetic acid

2-imidazo[1,5-a]pyridin-7-ylacetic acid (PubChem CID 83827565) has the molecular formula C9H8N2O2 and a molecular weight of 176.17 g/mol. Its IUPAC name is 2-imidazo[1,5-a]pyridin-7-ylacetic acid.

Molecular Properties

Compound Name2-imidazo[1,5-a]pyridin-7-ylacetic acid
PubChem CID83827565
Molecular FormulaC9H8N2O2
Molecular Weight176.17 g/mol
Exact Mass176.06
IUPAC Name2-imidazo[1,5-a]pyridin-7-ylacetic acid
SMILESO=C(O)Cc1ccn2cncc2c1
InChIInChI=1S/C9H8N2O2/c12-9(13)4-7-1-2-11-6-10-5-8(11)3-7/h1-3,5-6H,4H2,(H,12,13)
InChIKeyBFPHCNALFGRYJJ-UHFFFAOYSA-N
XLogP0.96
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.17
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-imidazo[1,5-a]pyridin-7-ylacetic acid?
The IUPAC name of 2-imidazo[1,5-a]pyridin-7-ylacetic acid (CID 83827565) is 2-imidazo[1,5-a]pyridin-7-ylacetic acid.
What is the SMILES notation for 2-imidazo[1,5-a]pyridin-7-ylacetic acid?
The canonical SMILES for 2-imidazo[1,5-a]pyridin-7-ylacetic acid is O=C(O)Cc1ccn2cncc2c1.
What is the InChIKey of 2-imidazo[1,5-a]pyridin-7-ylacetic acid?
The InChIKey is BFPHCNALFGRYJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O2/c12-9(13)4-7-1-2-11-6-10-5-8(11)3-7/h1-3,5-6H,4H2,(H,12,13).
What are the key properties of 2-imidazo[1,5-a]pyridin-7-ylacetic acid?
2-imidazo[1,5-a]pyridin-7-ylacetic acid has a molecular weight of 176.17 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazo[1,5-a]pyridin-7-ylacetic acid is sourced from PubChem (CID 83827565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).