(7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine

C8H12N4O2S — CID 65046768

IUPAC(7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine
SMILESCS(=O)(=O)C1CCc2cc(NN)nnc21
InChIInChI=1S/C8H12N4O2S/c1-15(13,14)6-3-2-5-4-7(10-9)11-12-8(5)6/h4,6H,2-3,9H2,1H3,(H,10,11)
InChIKeyVHKDVKSNFLUAMB-UHFFFAOYSA-N
MW228.28 g/mol
LogP-0.21
Rot. Bonds2

About (7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine

(7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine (PubChem CID 65046768) has the molecular formula C8H12N4O2S and a molecular weight of 228.28 g/mol. Its IUPAC name is (7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine.

Molecular Properties

Compound Name(7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine
PubChem CID65046768
Molecular FormulaC8H12N4O2S
Molecular Weight228.28 g/mol
Exact Mass228.07
IUPAC Name(7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine
SMILESCS(=O)(=O)C1CCc2cc(NN)nnc21
InChIInChI=1S/C8H12N4O2S/c1-15(13,14)6-3-2-5-4-7(10-9)11-12-8(5)6/h4,6H,2-3,9H2,1H3,(H,10,11)
InChIKeyVHKDVKSNFLUAMB-UHFFFAOYSA-N
XLogP-0.21
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.28
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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 (7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine?
The IUPAC name of (7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine (CID 65046768) is (7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine.
What is the SMILES notation for (7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine?
The canonical SMILES for (7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine is CS(=O)(=O)C1CCc2cc(NN)nnc21.
What is the InChIKey of (7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine?
The InChIKey is VHKDVKSNFLUAMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O2S/c1-15(13,14)6-3-2-5-4-7(10-9)11-12-8(5)6/h4,6H,2-3,9H2,1H3,(H,10,11).
What are the key properties of (7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine?
(7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine has a molecular weight of 228.28 g/mol, XLogP of -0.21, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methylsulfonyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)hydrazine is sourced from PubChem (CID 65046768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).