[(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine

C17H20F2N2 — CID 105303861

IUPAC[(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine
SMILESCCCc1ccc(C(NN)c2cc(C)c(F)cc2F)cc1
InChIInChI=1S/C17H20F2N2/c1-3-4-12-5-7-13(8-6-12)17(21-20)14-9-11(2)15(18)10-16(14)19/h5-10,17,21H,3-4,20H2,1-2H3
InChIKeyVCMATXPRQIUMCE-UHFFFAOYSA-N
MW290.36 g/mol
LogP3.78
Rot. Bonds5

About [(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine

[(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine (PubChem CID 105303861) has the molecular formula C17H20F2N2 and a molecular weight of 290.36 g/mol. Its IUPAC name is [(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine
PubChem CID105303861
Molecular FormulaC17H20F2N2
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name[(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine
SMILESCCCc1ccc(C(NN)c2cc(C)c(F)cc2F)cc1
InChIInChI=1S/C17H20F2N2/c1-3-4-12-5-7-13(8-6-12)17(21-20)14-9-11(2)15(18)10-16(14)19/h5-10,17,21H,3-4,20H2,1-2H3
InChIKeyVCMATXPRQIUMCE-UHFFFAOYSA-N
XLogP3.78
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 53.78
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 [(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine?
The IUPAC name of [(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine (CID 105303861) is [(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine.
What is the SMILES notation for [(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine?
The canonical SMILES for [(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine is CCCc1ccc(C(NN)c2cc(C)c(F)cc2F)cc1.
What is the InChIKey of [(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine?
The InChIKey is VCMATXPRQIUMCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20F2N2/c1-3-4-12-5-7-13(8-6-12)17(21-20)14-9-11(2)15(18)10-16(14)19/h5-10,17,21H,3-4,20H2,1-2H3.
What are the key properties of [(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine?
[(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine has a molecular weight of 290.36 g/mol, XLogP of 3.78, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,4-difluoro-5-methylphenyl)-(4-propylphenyl)methyl]hydrazine is sourced from PubChem (CID 105303861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).