[(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine

C14H15BrN2 — CID 105282916

IUPAC[(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine
SMILESCc1ccc(C(NN)c2ccccc2)c(Br)c1
InChIInChI=1S/C14H15BrN2/c1-10-7-8-12(13(15)9-10)14(17-16)11-5-3-2-4-6-11/h2-9,14,17H,16H2,1H3
InChIKeyKDFNHDYSNXVVKC-UHFFFAOYSA-N
MW291.19 g/mol
LogP3.31
Rot. Bonds3

About [(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine

[(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine (PubChem CID 105282916) has the molecular formula C14H15BrN2 and a molecular weight of 291.19 g/mol. Its IUPAC name is [(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine.

Molecular Properties

Compound Name[(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine
PubChem CID105282916
Molecular FormulaC14H15BrN2
Molecular Weight291.19 g/mol
Exact Mass290.04
IUPAC Name[(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine
SMILESCc1ccc(C(NN)c2ccccc2)c(Br)c1
InChIInChI=1S/C14H15BrN2/c1-10-7-8-12(13(15)9-10)14(17-16)11-5-3-2-4-6-11/h2-9,14,17H,16H2,1H3
InChIKeyKDFNHDYSNXVVKC-UHFFFAOYSA-N
XLogP3.31
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.19
LogP ≤ 53.31
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-bromo-4-methylphenyl)-phenylmethyl]hydrazine?
The IUPAC name of [(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine (CID 105282916) is [(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine.
What is the SMILES notation for [(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine?
The canonical SMILES for [(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine is Cc1ccc(C(NN)c2ccccc2)c(Br)c1.
What is the InChIKey of [(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine?
The InChIKey is KDFNHDYSNXVVKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2/c1-10-7-8-12(13(15)9-10)14(17-16)11-5-3-2-4-6-11/h2-9,14,17H,16H2,1H3.
What are the key properties of [(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine?
[(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine has a molecular weight of 291.19 g/mol, XLogP of 3.31, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-bromo-4-methylphenyl)-phenylmethyl]hydrazine is sourced from PubChem (CID 105282916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).