[5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine

C8H12N4OS — CID 166754683

IUPAC[5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine
SMILES[H]N=S(=O)(c1ccc(NN)nc1)C1CC1
InChIInChI=1S/C8H12N4OS/c9-12-8-4-3-7(5-11-8)14(10,13)6-1-2-6/h3-6,10H,1-2,9H2,(H,11,12)
InChIKeyHBSSHINHZFDTJQ-UHFFFAOYSA-N
MW212.28 g/mol
LogP0.94
Rot. Bonds3

About [5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine

[5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine (PubChem CID 166754683) has the molecular formula C8H12N4OS and a molecular weight of 212.28 g/mol. Its IUPAC name is [5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine
PubChem CID166754683
Molecular FormulaC8H12N4OS
Molecular Weight212.28 g/mol
Exact Mass212.07
IUPAC Name[5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine
SMILES[H]N=S(=O)(c1ccc(NN)nc1)C1CC1
InChIInChI=1S/C8H12N4OS/c9-12-8-4-3-7(5-11-8)14(10,13)6-1-2-6/h3-6,10H,1-2,9H2,(H,11,12)
InChIKeyHBSSHINHZFDTJQ-UHFFFAOYSA-N
XLogP0.94
TPSA91.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.28
LogP ≤ 50.94
H-Bond Donors ≤ 53
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 [5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine?
The IUPAC name of [5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine (CID 166754683) is [5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine.
What is the SMILES notation for [5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine?
The canonical SMILES for [5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine is [H]N=S(=O)(c1ccc(NN)nc1)C1CC1.
What is the InChIKey of [5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine?
The InChIKey is HBSSHINHZFDTJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4OS/c9-12-8-4-3-7(5-11-8)14(10,13)6-1-2-6/h3-6,10H,1-2,9H2,(H,11,12).
What are the key properties of [5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine?
[5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine has a molecular weight of 212.28 g/mol, XLogP of 0.94, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine is sourced from PubChem (CID 166754683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).