1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine

C9H9N7 — CID 103386199

IUPAC1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine
SMILESCn1cnc2c(-n3cnc(N)n3)nccc21
InChIInChI=1S/C9H9N7/c1-15-4-12-7-6(15)2-3-11-8(7)16-5-13-9(10)14-16/h2-5H,1H3,(H2,10,14)
InChIKeyFCHZUSBYZLZFHH-UHFFFAOYSA-N
MW215.22 g/mol
LogP0.13
Rot. Bonds1

About 1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine

1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine (PubChem CID 103386199) has the molecular formula C9H9N7 and a molecular weight of 215.22 g/mol. Its IUPAC name is 1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine.

Molecular Properties

Compound Name1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine
PubChem CID103386199
Molecular FormulaC9H9N7
Molecular Weight215.22 g/mol
Exact Mass215.09
IUPAC Name1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine
SMILESCn1cnc2c(-n3cnc(N)n3)nccc21
InChIInChI=1S/C9H9N7/c1-15-4-12-7-6(15)2-3-11-8(7)16-5-13-9(10)14-16/h2-5H,1H3,(H2,10,14)
InChIKeyFCHZUSBYZLZFHH-UHFFFAOYSA-N
XLogP0.13
TPSA87.44 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.22
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine?
The IUPAC name of 1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine (CID 103386199) is 1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine.
What is the SMILES notation for 1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine?
The canonical SMILES for 1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine is Cn1cnc2c(-n3cnc(N)n3)nccc21.
What is the InChIKey of 1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine?
The InChIKey is FCHZUSBYZLZFHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N7/c1-15-4-12-7-6(15)2-3-11-8(7)16-5-13-9(10)14-16/h2-5H,1H3,(H2,10,14).
What are the key properties of 1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine?
1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine has a molecular weight of 215.22 g/mol, XLogP of 0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylimidazo[4,5-c]pyridin-4-yl)-1,2,4-triazol-3-amine is sourced from PubChem (CID 103386199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).