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

C6H4N4O — CID 105429148

IUPACimidazo[1,5-b][1,2,4]triazine-8-carbaldehyde
SMILESO=Cc1ncn2nccnc12
InChIInChI=1S/C6H4N4O/c11-3-5-6-7-1-2-9-10(6)4-8-5/h1-4H
InChIKeyMMEYBOZHHCOMFD-UHFFFAOYSA-N
MW148.12 g/mol
LogP-0.06
Rot. Bonds1

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

imidazo[1,5-b][1,2,4]triazine-8-carbaldehyde (PubChem CID 105429148) has the molecular formula C6H4N4O and a molecular weight of 148.12 g/mol. Its IUPAC name is imidazo[1,5-b][1,2,4]triazine-8-carbaldehyde.

Molecular Properties

Compound Nameimidazo[1,5-b][1,2,4]triazine-8-carbaldehyde
PubChem CID105429148
Molecular FormulaC6H4N4O
Molecular Weight148.12 g/mol
Exact Mass148.04
IUPAC Nameimidazo[1,5-b][1,2,4]triazine-8-carbaldehyde
SMILESO=Cc1ncn2nccnc12
InChIInChI=1S/C6H4N4O/c11-3-5-6-7-1-2-9-10(6)4-8-5/h1-4H
InChIKeyMMEYBOZHHCOMFD-UHFFFAOYSA-N
XLogP-0.06
TPSA60.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.12
LogP ≤ 5-0.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

imidazo[1,5-b][1,2,4]triazine-8-carbonitrile
CID 105428725
imidazo[1,2-b][1,2,4]triazine-6-carbaldehyde
CID 58764268
2-pyrazolo[1,5-a]pyrimidin-3-ylacetaldehyde
CID 83872984
5-bromo-1-methylimidazole-4-carbaldehyde
CID 12742278
2,3-diphosphorosopyrazine
CID 150073121
4-methyl-3-oxopyrido[2,3-b]pyrazine-2-carbaldehyde
CID 86730915
3-chloroimidazo[1,2-a]pyrazine-8-carbaldehyde
CID 84658223
7-aminoimidazo[1,2-c]pyrimidine-8-carbaldehyde
CID 145057079
8-bromoimidazo[1,5-a]pyrazine-1-carbaldehyde
CID 76849777
2-methylimidazo[1,2-a]pyrazine-8-carbaldehyde
CID 84651184
6-amino-[1,2,4]triazolo[1,5-a]pyrimidine-2-carbaldehyde
CID 84651506
6-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbaldehyde
CID 83826757

Frequently Asked Questions

What is the IUPAC name of imidazo[1,5-b][1,2,4]triazine-8-carbaldehyde?
The IUPAC name of imidazo[1,5-b][1,2,4]triazine-8-carbaldehyde (CID 105429148) is imidazo[1,5-b][1,2,4]triazine-8-carbaldehyde.
What is the SMILES notation for imidazo[1,5-b][1,2,4]triazine-8-carbaldehyde?
The canonical SMILES for imidazo[1,5-b][1,2,4]triazine-8-carbaldehyde is O=Cc1ncn2nccnc12.
What is the InChIKey of imidazo[1,5-b][1,2,4]triazine-8-carbaldehyde?
The InChIKey is MMEYBOZHHCOMFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N4O/c11-3-5-6-7-1-2-9-10(6)4-8-5/h1-4H.
What are the key properties of imidazo[1,5-b][1,2,4]triazine-8-carbaldehyde?
imidazo[1,5-b][1,2,4]triazine-8-carbaldehyde has a molecular weight of 148.12 g/mol, XLogP of -0.06, 1 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-carbaldehyde is sourced from PubChem (CID 105429148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).