[1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine

C12H18BrClN2 — CID 107948109

IUPAC[1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine
SMILESCC(C)CCC(NN)c1cc(Cl)cc(Br)c1
InChIInChI=1S/C12H18BrClN2/c1-8(2)3-4-12(16-15)9-5-10(13)7-11(14)6-9/h5-8,12,16H,3-4,15H2,1-2H3
InChIKeyUNHPQZWHTYNJED-UHFFFAOYSA-N
MW305.65 g/mol
LogP4.04
Rot. Bonds5

About [1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine

[1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine (PubChem CID 107948109) has the molecular formula C12H18BrClN2 and a molecular weight of 305.65 g/mol. Its IUPAC name is [1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine
PubChem CID107948109
Molecular FormulaC12H18BrClN2
Molecular Weight305.65 g/mol
Exact Mass304.03
IUPAC Name[1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine
SMILESCC(C)CCC(NN)c1cc(Cl)cc(Br)c1
InChIInChI=1S/C12H18BrClN2/c1-8(2)3-4-12(16-15)9-5-10(13)7-11(14)6-9/h5-8,12,16H,3-4,15H2,1-2H3
InChIKeyUNHPQZWHTYNJED-UHFFFAOYSA-N
XLogP4.04
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.65
LogP ≤ 54.04
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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Related Compounds

[1-(3-bromo-5-chlorophenyl)-3-methylbutyl]hydrazine
CID 107947997
1-(3-bromo-5-chlorophenyl)pent-4-enylhydrazine
CID 107948273
[1-(3-bromo-5-chlorophenyl)-2-propoxyethyl]hydrazine
CID 107948361
1-(3,5-dichlorophenyl)butylhydrazine
CID 105282259
[1-(3-bromo-5-chlorophenyl)-2-[2-(2-methylpropyl)-1,2,4-triazol-3-yl]ethyl]hydrazine
CID 107948328
[1-(3-bromo-5-chlorophenyl)-2-(4-iodophenyl)ethyl]hydrazine
CID 114019542
[1-(3-bromo-5-chlorophenyl)-2-(2-chlorophenyl)ethyl]hydrazine
CID 114019513
[1-(3-bromo-5-chlorophenyl)-2-(3-bromo-5-fluorophenyl)ethyl]hydrazine
CID 107948391
1-(3,5-dibromophenyl)pentylhydrazine
CID 107978974
[1-(3-bromo-5-chlorophenyl)-2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine
CID 107948303
[1-(3-bromo-5-chlorophenyl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine
CID 107948316
[1-(3-bromo-5-chlorophenyl)-2-(5-chloro-1,3-dimethylpyrazol-4-yl)ethyl]hydrazine
CID 107948485

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine?
The IUPAC name of [1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine (CID 107948109) is [1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine.
What is the SMILES notation for [1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine?
The canonical SMILES for [1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine is CC(C)CCC(NN)c1cc(Cl)cc(Br)c1.
What is the InChIKey of [1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine?
The InChIKey is UNHPQZWHTYNJED-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18BrClN2/c1-8(2)3-4-12(16-15)9-5-10(13)7-11(14)6-9/h5-8,12,16H,3-4,15H2,1-2H3.
What are the key properties of [1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine?
[1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine has a molecular weight of 305.65 g/mol, XLogP of 4.04, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromo-5-chlorophenyl)-4-methylpentyl]hydrazine is sourced from PubChem (CID 107948109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).