N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide

C8H9N5O2S2 — CID 67313707

IUPACN-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide
SMILESCc1nnc(N(N)S(=O)(=O)c2cccnc2)s1
InChIInChI=1S/C8H9N5O2S2/c1-6-11-12-8(16-6)13(9)17(14,15)7-3-2-4-10-5-7/h2-5H,9H2,1H3
InChIKeyBTNDRAIHEWDXSI-UHFFFAOYSA-N
MW271.33 g/mol
LogP0.31
Rot. Bonds3

About N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide

N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide (PubChem CID 67313707) has the molecular formula C8H9N5O2S2 and a molecular weight of 271.33 g/mol. Its IUPAC name is N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide.

Molecular Properties

Compound NameN-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide
PubChem CID67313707
Molecular FormulaC8H9N5O2S2
Molecular Weight271.33 g/mol
Exact Mass271.02
IUPAC NameN-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide
SMILESCc1nnc(N(N)S(=O)(=O)c2cccnc2)s1
InChIInChI=1S/C8H9N5O2S2/c1-6-11-12-8(16-6)13(9)17(14,15)7-3-2-4-10-5-7/h2-5H,9H2,1H3
InChIKeyBTNDRAIHEWDXSI-UHFFFAOYSA-N
XLogP0.31
TPSA102.07 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.33
LogP ≤ 50.31
H-Bond Donors ≤ 51
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 N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide?
The IUPAC name of N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide (CID 67313707) is N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide.
What is the SMILES notation for N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide?
The canonical SMILES for N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide is Cc1nnc(N(N)S(=O)(=O)c2cccnc2)s1.
What is the InChIKey of N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide?
The InChIKey is BTNDRAIHEWDXSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5O2S2/c1-6-11-12-8(16-6)13(9)17(14,15)7-3-2-4-10-5-7/h2-5H,9H2,1H3.
What are the key properties of N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide?
N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide has a molecular weight of 271.33 g/mol, XLogP of 0.31, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonohydrazide is sourced from PubChem (CID 67313707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).