[5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine

C12H12IN3O — CID 62246023

IUPAC[5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine
SMILESNNc1ccc(COc2ccccc2I)cn1
InChIInChI=1S/C12H12IN3O/c13-10-3-1-2-4-11(10)17-8-9-5-6-12(16-14)15-7-9/h1-7H,8,14H2,(H,15,16)
InChIKeyKWIMVQKVPJSSNA-UHFFFAOYSA-N
MW341.15 g/mol
LogP2.55
Rot. Bonds4

About [5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine

[5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine (PubChem CID 62246023) has the molecular formula C12H12IN3O and a molecular weight of 341.15 g/mol. Its IUPAC name is [5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine
PubChem CID62246023
Molecular FormulaC12H12IN3O
Molecular Weight341.15 g/mol
Exact Mass341.00
IUPAC Name[5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine
SMILESNNc1ccc(COc2ccccc2I)cn1
InChIInChI=1S/C12H12IN3O/c13-10-3-1-2-4-11(10)17-8-9-5-6-12(16-14)15-7-9/h1-7H,8,14H2,(H,15,16)
InChIKeyKWIMVQKVPJSSNA-UHFFFAOYSA-N
XLogP2.55
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.15
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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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Related Compounds

2-chloro-5-[(2-iodophenoxy)methyl]pyridine
CID 43428206
[5-[(2-bromo-4-chlorophenoxy)methyl]-2-pyridinyl]hydrazine
CID 62246224
[5-[(2-fluoro-5-methylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 64855843
1-iodo-2-[(4-methylphenyl)methoxy]benzene
CID 63530114
[5-[(3-bromophenoxy)methyl]-2-pyridinyl]hydrazine
CID 62246032
[5-[(2-tert-butyl-4-methylphenoxy)methyl]-2-pyridinyl]hydrazine
CID 62244490
[5-[(4-chlorophenyl)methoxymethyl]-2-pyridinyl]hydrazine
CID 65125676
5-[(2-chlorophenoxy)methyl]-N-methylpyridin-2-amine
CID 55044923
1,2-bis[(2-iodophenoxy)methyl]benzene
CID 154951075
[5-[(2-methoxyphenyl)sulfanylmethyl]-2-pyridinyl]hydrazine
CID 62250828
[5-(2-methylpropoxymethyl)-2-pyridinyl]hydrazine
CID 62245064
[5-(2,2,2-trifluoroethoxymethyl)-2-pyridinyl]hydrazine
CID 62244487

Frequently Asked Questions

What is the IUPAC name of [5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine?
The IUPAC name of [5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine (CID 62246023) is [5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine.
What is the SMILES notation for [5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine?
The canonical SMILES for [5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine is NNc1ccc(COc2ccccc2I)cn1.
What is the InChIKey of [5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine?
The InChIKey is KWIMVQKVPJSSNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12IN3O/c13-10-3-1-2-4-11(10)17-8-9-5-6-12(16-14)15-7-9/h1-7H,8,14H2,(H,15,16).
What are the key properties of [5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine?
[5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine has a molecular weight of 341.15 g/mol, XLogP of 2.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine is sourced from PubChem (CID 62246023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).