[3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine

C8H8Cl2N6O — CID 106598864

IUPAC[3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine
SMILESCn1cnc(Oc2nc(NN)c(Cl)cc2Cl)n1
InChIInChI=1S/C8H8Cl2N6O/c1-16-3-12-8(15-16)17-7-5(10)2-4(9)6(13-7)14-11/h2-3H,11H2,1H3,(H,13,14)
InChIKeyZIBKONVAAGGIHC-UHFFFAOYSA-N
MW275.10 g/mol
LogP1.59
Rot. Bonds3

About [3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine

[3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine (PubChem CID 106598864) has the molecular formula C8H8Cl2N6O and a molecular weight of 275.10 g/mol. Its IUPAC name is [3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine
PubChem CID106598864
Molecular FormulaC8H8Cl2N6O
Molecular Weight275.10 g/mol
Exact Mass274.01
IUPAC Name[3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine
SMILESCn1cnc(Oc2nc(NN)c(Cl)cc2Cl)n1
InChIInChI=1S/C8H8Cl2N6O/c1-16-3-12-8(15-16)17-7-5(10)2-4(9)6(13-7)14-11/h2-3H,11H2,1H3,(H,13,14)
InChIKeyZIBKONVAAGGIHC-UHFFFAOYSA-N
XLogP1.59
TPSA90.88 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.10
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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 [3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine?
The IUPAC name of [3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine (CID 106598864) is [3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine.
What is the SMILES notation for [3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine?
The canonical SMILES for [3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine is Cn1cnc(Oc2nc(NN)c(Cl)cc2Cl)n1.
What is the InChIKey of [3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine?
The InChIKey is ZIBKONVAAGGIHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8Cl2N6O/c1-16-3-12-8(15-16)17-7-5(10)2-4(9)6(13-7)14-11/h2-3H,11H2,1H3,(H,13,14).
What are the key properties of [3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine?
[3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine has a molecular weight of 275.10 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [3,5-dichloro-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]-2-pyridinyl]hydrazine is sourced from PubChem (CID 106598864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).