[(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine

C16H19IN2O — CID 105304077

IUPAC[(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine
SMILESCC(C)Oc1ccc(C(NN)c2cccc(I)c2)cc1
InChIInChI=1S/C16H19IN2O/c1-11(2)20-15-8-6-12(7-9-15)16(19-18)13-4-3-5-14(17)10-13/h3-11,16,19H,18H2,1-2H3
InChIKeyWHBRWOVQBIMQPM-UHFFFAOYSA-N
MW382.25 g/mol
LogP3.63
Rot. Bonds5

About [(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine

[(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine (PubChem CID 105304077) has the molecular formula C16H19IN2O and a molecular weight of 382.25 g/mol. Its IUPAC name is [(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine
PubChem CID105304077
Molecular FormulaC16H19IN2O
Molecular Weight382.25 g/mol
Exact Mass382.05
IUPAC Name[(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine
SMILESCC(C)Oc1ccc(C(NN)c2cccc(I)c2)cc1
InChIInChI=1S/C16H19IN2O/c1-11(2)20-15-8-6-12(7-9-15)16(19-18)13-4-3-5-14(17)10-13/h3-11,16,19H,18H2,1-2H3
InChIKeyWHBRWOVQBIMQPM-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

[(2,6-dichlorophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine
CID 105304128
[(4-bromo-3-fluorophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine
CID 105304152
[(3-fluorophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine
CID 105193073
[(2-iodophenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine
CID 105326447
[(4-propan-2-yloxyphenyl)-pyrimidin-5-ylmethyl]hydrazine
CID 102924195
[(3-ethylphenyl)-(3-iodophenyl)methyl]hydrazine
CID 105326224
[(3-fluoro-4-methylphenyl)-(3-propan-2-yloxyphenyl)methyl]hydrazine
CID 105201578
[(5-bromo-3-pyridinyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine
CID 105251286
[(3-iodophenyl)-(2-methylphenyl)methyl]hydrazine
CID 105285986
N-[(3-iodophenyl)-(4-methoxyphenyl)methyl]ethanamine
CID 43489185
[(2-ethylphenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine
CID 105304185
N-[(4-ethoxyphenyl)-(3-iodophenyl)methyl]ethanamine
CID 43489415

Frequently Asked Questions

What is the IUPAC name of [(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine?
The IUPAC name of [(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine (CID 105304077) is [(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine?
The canonical SMILES for [(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine is CC(C)Oc1ccc(C(NN)c2cccc(I)c2)cc1.
What is the InChIKey of [(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine?
The InChIKey is WHBRWOVQBIMQPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19IN2O/c1-11(2)20-15-8-6-12(7-9-15)16(19-18)13-4-3-5-14(17)10-13/h3-11,16,19H,18H2,1-2H3.
What are the key properties of [(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine?
[(3-iodophenyl)-(4-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 [(3-iodophenyl)-(4-propan-2-yloxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105304077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).