(E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine

C5H6IN3 — CID 178186249

IUPAC(E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine
SMILESN/N=C1/N=CC=CC1I
InChIInChI=1S/C5H6IN3/c6-4-2-1-3-8-5(4)9-7/h1-4H,7H2/b9-5+
InChIKeySYMBAQIDHBRQGT-WEVVVXLNSA-N
MW235.03 g/mol
LogP0.70
Rot. Bonds

About (E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine

(E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine (PubChem CID 178186249) has the molecular formula C5H6IN3 and a molecular weight of 235.03 g/mol. Its IUPAC name is (E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine.

Molecular Properties

Compound Name(E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine
PubChem CID178186249
Molecular FormulaC5H6IN3
Molecular Weight235.03 g/mol
Exact Mass234.96
IUPAC Name(E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine
SMILESN/N=C1/N=CC=CC1I
InChIInChI=1S/C5H6IN3/c6-4-2-1-3-8-5(4)9-7/h1-4H,7H2/b9-5+
InChIKeySYMBAQIDHBRQGT-WEVVVXLNSA-N
XLogP0.70
TPSA50.74 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.03
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(E)-(3-fluoro-3H-pyridin-6-ylidene)hydrazine
CID 156592463
4-iodo-3H-pyridin-6-imine
CID 135291601

Frequently Asked Questions

What is the IUPAC name of (E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine?
The IUPAC name of (E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine (CID 178186249) is (E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine.
What is the SMILES notation for (E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine?
The canonical SMILES for (E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine is N/N=C1/N=CC=CC1I.
What is the InChIKey of (E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine?
The InChIKey is SYMBAQIDHBRQGT-WEVVVXLNSA-N. The full InChI is InChI=1S/C5H6IN3/c6-4-2-1-3-8-5(4)9-7/h1-4H,7H2/b9-5+.
What are the key properties of (E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine?
(E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine has a molecular weight of 235.03 g/mol, XLogP of 0.70, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-(3-iodo-3H-pyridin-2-ylidene)hydrazine is sourced from PubChem (CID 178186249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).