[(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine

C16H19IN2O — CID 105326447

IUPAC[(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine
SMILESCC(C)Oc1cccc(C(NN)c2ccccc2I)c1
InChIInChI=1S/C16H19IN2O/c1-11(2)20-13-7-5-6-12(10-13)16(19-18)14-8-3-4-9-15(14)17/h3-11,16,19H,18H2,1-2H3
InChIKeyWTRITHPEQWFDST-UHFFFAOYSA-N
MW382.25 g/mol
LogP3.63
Rot. Bonds5

About [(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine

[(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine (PubChem CID 105326447) has the molecular formula C16H19IN2O and a molecular weight of 382.25 g/mol. Its IUPAC name is [(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine
PubChem CID105326447
Molecular FormulaC16H19IN2O
Molecular Weight382.25 g/mol
Exact Mass382.05
IUPAC Name[(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine
SMILESCC(C)Oc1cccc(C(NN)c2ccccc2I)c1
InChIInChI=1S/C16H19IN2O/c1-11(2)20-13-7-5-6-12(10-13)16(19-18)14-8-3-4-9-15(14)17/h3-11,16,19H,18H2,1-2H3
InChIKeyWTRITHPEQWFDST-UHFFFAOYSA-N
XLogP3.63
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.25
LogP ≤ 53.63
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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Related Compounds

[(4-methyl-3-pyridinyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine
CID 105279871
[(3-fluorophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine
CID 105193073
[(2-iodophenyl)-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105304253
[(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine
CID 105304077
[(3-fluoro-4-methylphenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine
CID 105201578
[(3-propan-2-yloxyphenyl)-(thiadiazol-4-yl)methyl]hydrazine
CID 105326426
[(5-bromo-2-iodophenyl)-(3-methoxyphenyl)methyl]hydrazine
CID 114033147
[(1-methylpyrazol-3-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine
CID 105228760
N-methyl-1-(2-methylsulfanylphenyl)-1-(3-propan-2-yloxyphenyl)methanamine
CID 105019109
[(5-ethylfuran-2-yl)-(3-propan-2-yloxyphenyl)methyl]hydrazine
CID 105326476
[(2-bromophenyl)-(3-methoxyphenyl)methyl]hydrazine
CID 105208659
[2-(4-iodophenyl)-1-(3-propan-2-yloxyphenyl)ethyl]hydrazine
CID 105310242

Frequently Asked Questions

What is the IUPAC name of [(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine?
The IUPAC name of [(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine (CID 105326447) is [(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine?
The canonical SMILES for [(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine is CC(C)Oc1cccc(C(NN)c2ccccc2I)c1.
What is the InChIKey of [(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine?
The InChIKey is WTRITHPEQWFDST-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19IN2O/c1-11(2)20-13-7-5-6-12(10-13)16(19-18)14-8-3-4-9-15(14)17/h3-11,16,19H,18H2,1-2H3.
What are the key properties of [(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine?
[(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine has a molecular weight of 382.25 g/mol, XLogP of 3.63, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105326447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).