1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine

C15H17IN2 — CID 162401436

IUPAC1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine
SMILESCc1cc(C)cc(N(N)Cc2ccc(I)cc2)c1
InChIInChI=1S/C15H17IN2/c1-11-7-12(2)9-15(8-11)18(17)10-13-3-5-14(16)6-4-13/h3-9H,10,17H2,1-2H3
InChIKeyJPFFCDSJHOZSJG-UHFFFAOYSA-N
MW352.22 g/mol
LogP3.79
Rot. Bonds3

About 1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine

1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine (PubChem CID 162401436) has the molecular formula C15H17IN2 and a molecular weight of 352.22 g/mol. Its IUPAC name is 1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine.

Molecular Properties

Compound Name1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine
PubChem CID162401436
Molecular FormulaC15H17IN2
Molecular Weight352.22 g/mol
Exact Mass352.04
IUPAC Name1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine
SMILESCc1cc(C)cc(N(N)Cc2ccc(I)cc2)c1
InChIInChI=1S/C15H17IN2/c1-11-7-12(2)9-15(8-11)18(17)10-13-3-5-14(16)6-4-13/h3-9H,10,17H2,1-2H3
InChIKeyJPFFCDSJHOZSJG-UHFFFAOYSA-N
XLogP3.79
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.22
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine?
The IUPAC name of 1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine (CID 162401436) is 1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine.
What is the SMILES notation for 1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine?
The canonical SMILES for 1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine is Cc1cc(C)cc(N(N)Cc2ccc(I)cc2)c1.
What is the InChIKey of 1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine?
The InChIKey is JPFFCDSJHOZSJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17IN2/c1-11-7-12(2)9-15(8-11)18(17)10-13-3-5-14(16)6-4-13/h3-9H,10,17H2,1-2H3.
What are the key properties of 1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine?
1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine has a molecular weight of 352.22 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethylphenyl)-1-[(4-iodophenyl)methyl]hydrazine is sourced from PubChem (CID 162401436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).