5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one

C6H8N6O — CID 512726

IUPAC5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one
SMILESNNc1cc2[nH]cnc2c(=O)n1N
InChIInChI=1S/C6H8N6O/c7-11-4-1-3-5(10-2-9-3)6(13)12(4)8/h1-2,11H,7-8H2,(H,9,10)
InChIKeyOANWYRGSXWEMDQ-UHFFFAOYSA-N
MW180.17 g/mol
LogP-1.28
Rot. Bonds1

About 5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one

5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one (PubChem CID 512726) has the molecular formula C6H8N6O and a molecular weight of 180.17 g/mol. Its IUPAC name is 5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one.

Molecular Properties

Compound Name5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one
PubChem CID512726
Molecular FormulaC6H8N6O
Molecular Weight180.17 g/mol
Exact Mass180.08
IUPAC Name5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one
SMILESNNc1cc2[nH]cnc2c(=O)n1N
InChIInChI=1S/C6H8N6O/c7-11-4-1-3-5(10-2-9-3)6(13)12(4)8/h1-2,11H,7-8H2,(H,9,10)
InChIKeyOANWYRGSXWEMDQ-UHFFFAOYSA-N
XLogP-1.28
TPSA114.75 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.17
LogP ≤ 5-1.28
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one?
The IUPAC name of 5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one (CID 512726) is 5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one.
What is the SMILES notation for 5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one?
The canonical SMILES for 5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one is NNc1cc2[nH]cnc2c(=O)n1N.
What is the InChIKey of 5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one?
The InChIKey is OANWYRGSXWEMDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N6O/c7-11-4-1-3-5(10-2-9-3)6(13)12(4)8/h1-2,11H,7-8H2,(H,9,10).
What are the key properties of 5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one?
5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one has a molecular weight of 180.17 g/mol, XLogP of -1.28, 1 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-hydrazinyl-1H-imidazo[4,5-c]pyridin-4-one is sourced from PubChem (CID 512726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).