[5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine

C11H11N7S — CID 103062084

IUPAC[5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine
SMILESNNc1cnc(CSc2nnc3ccccn23)cn1
InChIInChI=1S/C11H11N7S/c12-15-9-6-13-8(5-14-9)7-19-11-17-16-10-3-1-2-4-18(10)11/h1-6H,7,12H2,(H,14,15)
InChIKeyBXEQLHJAGQKMHV-UHFFFAOYSA-N
MW273.32 g/mol
LogP1.10
Rot. Bonds4

About [5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine

[5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine (PubChem CID 103062084) has the molecular formula C11H11N7S and a molecular weight of 273.32 g/mol. Its IUPAC name is [5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine.

Molecular Properties

Compound Name[5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine
PubChem CID103062084
Molecular FormulaC11H11N7S
Molecular Weight273.32 g/mol
Exact Mass273.08
IUPAC Name[5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine
SMILESNNc1cnc(CSc2nnc3ccccn23)cn1
InChIInChI=1S/C11H11N7S/c12-15-9-6-13-8(5-14-9)7-19-11-17-16-10-3-1-2-4-18(10)11/h1-6H,7,12H2,(H,14,15)
InChIKeyBXEQLHJAGQKMHV-UHFFFAOYSA-N
XLogP1.10
TPSA94.02 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.32
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-amine
CID 103060119
N-propyl-5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-amine
CID 103060121
3-[(5-bromo-2-pyridinyl)methylsulfanyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 115622316
[4-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)phenyl]methanamine
CID 62848938
5-chloro-6-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyridin-2-amine
CID 62886720
2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)furan-3-carbohydrazide
CID 63580694
(2S)-1-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)propan-2-amine
CID 104889221
[5-(naphthalen-2-ylsulfanylmethyl)pyrazin-2-yl]hydrazine
CID 103062053
[5-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine
CID 103062028
3-[2-(chloromethyl)prop-2-enylsulfanyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 103066297
2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)prop-2-ene-1-thiol
CID 103074186
2-bromo-5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)aniline
CID 115558374

Frequently Asked Questions

What is the IUPAC name of [5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine?
The IUPAC name of [5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine (CID 103062084) is [5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine.
What is the SMILES notation for [5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine?
The canonical SMILES for [5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine is NNc1cnc(CSc2nnc3ccccn23)cn1.
What is the InChIKey of [5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine?
The InChIKey is BXEQLHJAGQKMHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N7S/c12-15-9-6-13-8(5-14-9)7-19-11-17-16-10-3-1-2-4-18(10)11/h1-6H,7,12H2,(H,14,15).
What are the key properties of [5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine?
[5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine has a molecular weight of 273.32 g/mol, XLogP of 1.10, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [5-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanylmethyl)pyrazin-2-yl]hydrazine is sourced from PubChem (CID 103062084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).