imidazo[1,5-b][1,2,4]triazine-8-carbonitrile

C6H3N5 — CID 105428725

IUPACimidazo[1,5-b][1,2,4]triazine-8-carbonitrile
SMILESN#Cc1ncn2nccnc12
InChIInChI=1S/C6H3N5/c7-3-5-6-8-1-2-10-11(6)4-9-5/h1-2,4H
InChIKeyNVUOPJJTDGSXKM-UHFFFAOYSA-N
MW145.12 g/mol
LogP-0.00
Rot. Bonds

About imidazo[1,5-b][1,2,4]triazine-8-carbonitrile

imidazo[1,5-b][1,2,4]triazine-8-carbonitrile (PubChem CID 105428725) has the molecular formula C6H3N5 and a molecular weight of 145.12 g/mol. Its IUPAC name is imidazo[1,5-b][1,2,4]triazine-8-carbonitrile.

Molecular Properties

Compound Nameimidazo[1,5-b][1,2,4]triazine-8-carbonitrile
PubChem CID105428725
Molecular FormulaC6H3N5
Molecular Weight145.12 g/mol
Exact Mass145.04
IUPAC Nameimidazo[1,5-b][1,2,4]triazine-8-carbonitrile
SMILESN#Cc1ncn2nccnc12
InChIInChI=1S/C6H3N5/c7-3-5-6-8-1-2-10-11(6)4-9-5/h1-2,4H
InChIKeyNVUOPJJTDGSXKM-UHFFFAOYSA-N
XLogP-0.00
TPSA66.87 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.12
LogP ≤ 5-0.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of imidazo[1,5-b][1,2,4]triazine-8-carbonitrile?
The IUPAC name of imidazo[1,5-b][1,2,4]triazine-8-carbonitrile (CID 105428725) is imidazo[1,5-b][1,2,4]triazine-8-carbonitrile.
What is the SMILES notation for imidazo[1,5-b][1,2,4]triazine-8-carbonitrile?
The canonical SMILES for imidazo[1,5-b][1,2,4]triazine-8-carbonitrile is N#Cc1ncn2nccnc12.
What is the InChIKey of imidazo[1,5-b][1,2,4]triazine-8-carbonitrile?
The InChIKey is NVUOPJJTDGSXKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3N5/c7-3-5-6-8-1-2-10-11(6)4-9-5/h1-2,4H.
What are the key properties of imidazo[1,5-b][1,2,4]triazine-8-carbonitrile?
imidazo[1,5-b][1,2,4]triazine-8-carbonitrile has a molecular weight of 145.12 g/mol, XLogP of -0.00, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,5-b][1,2,4]triazine-8-carbonitrile is sourced from PubChem (CID 105428725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).