2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid

C9H7ClN2O2 — CID 83869395

IUPAC2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid
SMILESO=C(O)Cc1ncn2ccc(Cl)cc12
InChIInChI=1S/C9H7ClN2O2/c10-6-1-2-12-5-11-7(4-9(13)14)8(12)3-6/h1-3,5H,4H2,(H,13,14)
InChIKeyXZROFYNLOQICJU-UHFFFAOYSA-N
MW210.62 g/mol
LogP1.61
Rot. Bonds2

About 2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid

2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid (PubChem CID 83869395) has the molecular formula C9H7ClN2O2 and a molecular weight of 210.62 g/mol. Its IUPAC name is 2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid.

Molecular Properties

Compound Name2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid
PubChem CID83869395
Molecular FormulaC9H7ClN2O2
Molecular Weight210.62 g/mol
Exact Mass210.02
IUPAC Name2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid
SMILESO=C(O)Cc1ncn2ccc(Cl)cc12
InChIInChI=1S/C9H7ClN2O2/c10-6-1-2-12-5-11-7(4-9(13)14)8(12)3-6/h1-3,5H,4H2,(H,13,14)
InChIKeyXZROFYNLOQICJU-UHFFFAOYSA-N
XLogP1.61
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.62
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid?
The IUPAC name of 2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid (CID 83869395) is 2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid.
What is the SMILES notation for 2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid?
The canonical SMILES for 2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid is O=C(O)Cc1ncn2ccc(Cl)cc12.
What is the InChIKey of 2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid?
The InChIKey is XZROFYNLOQICJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN2O2/c10-6-1-2-12-5-11-7(4-9(13)14)8(12)3-6/h1-3,5H,4H2,(H,13,14).
What are the key properties of 2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid?
2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid has a molecular weight of 210.62 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-chloroimidazo[1,5-a]pyridin-1-yl)acetic acid is sourced from PubChem (CID 83869395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).