[1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine

C13H21BrN2 — CID 105284586

IUPAC[1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine
SMILESCCCC(C)C(Cc1cccc(Br)c1)NN
InChIInChI=1S/C13H21BrN2/c1-3-5-10(2)13(16-15)9-11-6-4-7-12(14)8-11/h4,6-8,10,13,16H,3,5,9,15H2,1-2H3
InChIKeyZVGBRYMTHDOVBV-UHFFFAOYSA-N
MW285.23 g/mol
LogP3.26
Rot. Bonds6

About [1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine

[1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine (PubChem CID 105284586) has the molecular formula C13H21BrN2 and a molecular weight of 285.23 g/mol. Its IUPAC name is [1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine
PubChem CID105284586
Molecular FormulaC13H21BrN2
Molecular Weight285.23 g/mol
Exact Mass284.09
IUPAC Name[1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine
SMILESCCCC(C)C(Cc1cccc(Br)c1)NN
InChIInChI=1S/C13H21BrN2/c1-3-5-10(2)13(16-15)9-11-6-4-7-12(14)8-11/h4,6-8,10,13,16H,3,5,9,15H2,1-2H3
InChIKeyZVGBRYMTHDOVBV-UHFFFAOYSA-N
XLogP3.26
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.23
LogP ≤ 53.26
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-fluorophenyl)-3-methylhexan-2-yl]hydrazine
CID 105286424
[1-(3-bromophenyl)-3-ethylheptan-2-yl]hydrazine
CID 105284555
[1-(4-bromo-2-chlorophenyl)-3-methylhexan-2-yl]hydrazine
CID 105335234
1-(3-bromophenyl)heptan-2-ylhydrazine
CID 105202849
[1-(3,5-dimethylphenyl)-3-methylhexan-2-yl]hydrazine
CID 105287241
[1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine
CID 105204829
N-[(3-bromophenyl)methyl]pentan-2-amine
CID 43177710
[1-(3-fluorophenyl)-3-propylhexan-2-yl]hydrazine
CID 105286352
1-(3-bromophenyl)-3-ethyl-N-methylheptan-2-amine
CID 63528117
[1-(3-bromophenyl)-3-propylsulfanylpropan-2-yl]hydrazine
CID 105225748
1-(3-bromophenyl)heptan-4-amine
CID 64504358
1-(3-bromophenyl)-N-propan-2-ylhexan-2-amine
CID 79412796

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine?
The IUPAC name of [1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine (CID 105284586) is [1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine.
What is the SMILES notation for [1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine?
The canonical SMILES for [1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine is CCCC(C)C(Cc1cccc(Br)c1)NN.
What is the InChIKey of [1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine?
The InChIKey is ZVGBRYMTHDOVBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21BrN2/c1-3-5-10(2)13(16-15)9-11-6-4-7-12(14)8-11/h4,6-8,10,13,16H,3,5,9,15H2,1-2H3.
What are the key properties of [1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine?
[1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine has a molecular weight of 285.23 g/mol, XLogP of 3.26, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine is sourced from PubChem (CID 105284586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).