[2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine

C13H14IN3 — CID 105196467

IUPAC[2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine
SMILESNNC(Cc1ccc(I)cc1)c1ccncc1
InChIInChI=1S/C13H14IN3/c14-12-3-1-10(2-4-12)9-13(17-15)11-5-7-16-8-6-11/h1-8,13,17H,9,15H2
InChIKeyYUCAAXCVILOJOP-UHFFFAOYSA-N
MW339.18 g/mol
LogP2.43
Rot. Bonds4

About [2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine

[2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine (PubChem CID 105196467) has the molecular formula C13H14IN3 and a molecular weight of 339.18 g/mol. Its IUPAC name is [2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine
PubChem CID105196467
Molecular FormulaC13H14IN3
Molecular Weight339.18 g/mol
Exact Mass339.02
IUPAC Name[2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine
SMILESNNC(Cc1ccc(I)cc1)c1ccncc1
InChIInChI=1S/C13H14IN3/c14-12-3-1-10(2-4-12)9-13(17-15)11-5-7-16-8-6-11/h1-8,13,17H,9,15H2
InChIKeyYUCAAXCVILOJOP-UHFFFAOYSA-N
XLogP2.43
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.18
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'iodine', '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 [2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine?
The IUPAC name of [2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine (CID 105196467) is [2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine.
What is the SMILES notation for [2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine?
The canonical SMILES for [2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine is NNC(Cc1ccc(I)cc1)c1ccncc1.
What is the InChIKey of [2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine?
The InChIKey is YUCAAXCVILOJOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14IN3/c14-12-3-1-10(2-4-12)9-13(17-15)11-5-7-16-8-6-11/h1-8,13,17H,9,15H2.
What are the key properties of [2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine?
[2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine has a molecular weight of 339.18 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-iodophenyl)-1-pyridin-4-ylethyl]hydrazine is sourced from PubChem (CID 105196467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).