imidazo[1,5-a]pyridine-5,7-dicarbonitrile

C9H4N4 — CID 130066229

IUPACimidazo[1,5-a]pyridine-5,7-dicarbonitrile
SMILESN#Cc1cc(C#N)n2cncc2c1
InChIInChI=1S/C9H4N4/c10-3-7-1-8(4-11)13-6-12-5-9(13)2-7/h1-2,5-6H
InChIKeyOBRLEZOUBISDJW-UHFFFAOYSA-N
MW168.16 g/mol
LogP1.08
Rot. Bonds

About imidazo[1,5-a]pyridine-5,7-dicarbonitrile

imidazo[1,5-a]pyridine-5,7-dicarbonitrile (PubChem CID 130066229) has the molecular formula C9H4N4 and a molecular weight of 168.16 g/mol. Its IUPAC name is imidazo[1,5-a]pyridine-5,7-dicarbonitrile.

Molecular Properties

Compound Nameimidazo[1,5-a]pyridine-5,7-dicarbonitrile
PubChem CID130066229
Molecular FormulaC9H4N4
Molecular Weight168.16 g/mol
Exact Mass168.04
IUPAC Nameimidazo[1,5-a]pyridine-5,7-dicarbonitrile
SMILESN#Cc1cc(C#N)n2cncc2c1
InChIInChI=1S/C9H4N4/c10-3-7-1-8(4-11)13-6-12-5-9(13)2-7/h1-2,5-6H
InChIKeyOBRLEZOUBISDJW-UHFFFAOYSA-N
XLogP1.08
TPSA64.88 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.16
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of imidazo[1,5-a]pyridine-5,7-dicarbonitrile?
The IUPAC name of imidazo[1,5-a]pyridine-5,7-dicarbonitrile (CID 130066229) is imidazo[1,5-a]pyridine-5,7-dicarbonitrile.
What is the SMILES notation for imidazo[1,5-a]pyridine-5,7-dicarbonitrile?
The canonical SMILES for imidazo[1,5-a]pyridine-5,7-dicarbonitrile is N#Cc1cc(C#N)n2cncc2c1.
What is the InChIKey of imidazo[1,5-a]pyridine-5,7-dicarbonitrile?
The InChIKey is OBRLEZOUBISDJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H4N4/c10-3-7-1-8(4-11)13-6-12-5-9(13)2-7/h1-2,5-6H.
What are the key properties of imidazo[1,5-a]pyridine-5,7-dicarbonitrile?
imidazo[1,5-a]pyridine-5,7-dicarbonitrile has a molecular weight of 168.16 g/mol, XLogP of 1.08, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,5-a]pyridine-5,7-dicarbonitrile is sourced from PubChem (CID 130066229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).