(3-methylsulfonyl-2-pyridinyl)hydrazine

C6H9N3O2S — CID 55281997

IUPAC(3-methylsulfonyl-2-pyridinyl)hydrazine
SMILESCS(=O)(=O)c1cccnc1NN
InChIInChI=1S/C6H9N3O2S/c1-12(10,11)5-3-2-4-8-6(5)9-7/h2-4H,7H2,1H3,(H,8,9)
InChIKeyPFOVGLODTWVQCL-UHFFFAOYSA-N
MW187.22 g/mol
LogP-0.23
Rot. Bonds2

About (3-methylsulfonyl-2-pyridinyl)hydrazine

(3-methylsulfonyl-2-pyridinyl)hydrazine (PubChem CID 55281997) has the molecular formula C6H9N3O2S and a molecular weight of 187.22 g/mol. Its IUPAC name is (3-methylsulfonyl-2-pyridinyl)hydrazine.

Molecular Properties

Compound Name(3-methylsulfonyl-2-pyridinyl)hydrazine
PubChem CID55281997
Molecular FormulaC6H9N3O2S
Molecular Weight187.22 g/mol
Exact Mass187.04
IUPAC Name(3-methylsulfonyl-2-pyridinyl)hydrazine
SMILESCS(=O)(=O)c1cccnc1NN
InChIInChI=1S/C6H9N3O2S/c1-12(10,11)5-3-2-4-8-6(5)9-7/h2-4H,7H2,1H3,(H,8,9)
InChIKeyPFOVGLODTWVQCL-UHFFFAOYSA-N
XLogP-0.23
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.22
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-methylsulfonyl-2-pyridinyl)hydrazine?
The IUPAC name of (3-methylsulfonyl-2-pyridinyl)hydrazine (CID 55281997) is (3-methylsulfonyl-2-pyridinyl)hydrazine.
What is the SMILES notation for (3-methylsulfonyl-2-pyridinyl)hydrazine?
The canonical SMILES for (3-methylsulfonyl-2-pyridinyl)hydrazine is CS(=O)(=O)c1cccnc1NN.
What is the InChIKey of (3-methylsulfonyl-2-pyridinyl)hydrazine?
The InChIKey is PFOVGLODTWVQCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2S/c1-12(10,11)5-3-2-4-8-6(5)9-7/h2-4H,7H2,1H3,(H,8,9).
What are the key properties of (3-methylsulfonyl-2-pyridinyl)hydrazine?
(3-methylsulfonyl-2-pyridinyl)hydrazine has a molecular weight of 187.22 g/mol, XLogP of -0.23, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylsulfonyl-2-pyridinyl)hydrazine is sourced from PubChem (CID 55281997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).