[(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine

C17H21FN2 — CID 107130966

IUPAC[(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine
SMILESCc1cc(C)c(C(NN)c2ccc(C)c(F)c2)c(C)c1
InChIInChI=1S/C17H21FN2/c1-10-7-12(3)16(13(4)8-10)17(20-19)14-6-5-11(2)15(18)9-14/h5-9,17,20H,19H2,1-4H3
InChIKeyLUGRCPLHFFYSFD-UHFFFAOYSA-N
MW272.37 g/mol
LogP3.61
Rot. Bonds3

About [(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine

[(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine (PubChem CID 107130966) has the molecular formula C17H21FN2 and a molecular weight of 272.37 g/mol. Its IUPAC name is [(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine
PubChem CID107130966
Molecular FormulaC17H21FN2
Molecular Weight272.37 g/mol
Exact Mass272.17
IUPAC Name[(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine
SMILESCc1cc(C)c(C(NN)c2ccc(C)c(F)c2)c(C)c1
InChIInChI=1S/C17H21FN2/c1-10-7-12(3)16(13(4)8-10)17(20-19)14-6-5-11(2)15(18)9-14/h5-9,17,20H,19H2,1-4H3
InChIKeyLUGRCPLHFFYSFD-UHFFFAOYSA-N
XLogP3.61
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 [(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine?
The IUPAC name of [(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine (CID 107130966) is [(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine.
What is the SMILES notation for [(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine?
The canonical SMILES for [(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine is Cc1cc(C)c(C(NN)c2ccc(C)c(F)c2)c(C)c1.
What is the InChIKey of [(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine?
The InChIKey is LUGRCPLHFFYSFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN2/c1-10-7-12(3)16(13(4)8-10)17(20-19)14-6-5-11(2)15(18)9-14/h5-9,17,20H,19H2,1-4H3.
What are the key properties of [(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine?
[(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine has a molecular weight of 272.37 g/mol, XLogP of 3.61, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine is sourced from PubChem (CID 107130966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).