[1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine

C14H23BrN2 — CID 105331264

IUPAC[1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine
SMILESCc1ccc(C(CCCC(C)C)NN)c(Br)c1
InChIInChI=1S/C14H23BrN2/c1-10(2)5-4-6-14(17-16)12-8-7-11(3)9-13(12)15/h7-10,14,17H,4-6,16H2,1-3H3
InChIKeyMSUPODJLKOFGRK-UHFFFAOYSA-N
MW299.26 g/mol
LogP4.09
Rot. Bonds6

About [1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine

[1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine (PubChem CID 105331264) has the molecular formula C14H23BrN2 and a molecular weight of 299.26 g/mol. Its IUPAC name is [1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine
PubChem CID105331264
Molecular FormulaC14H23BrN2
Molecular Weight299.26 g/mol
Exact Mass298.10
IUPAC Name[1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine
SMILESCc1ccc(C(CCCC(C)C)NN)c(Br)c1
InChIInChI=1S/C14H23BrN2/c1-10(2)5-4-6-14(17-16)12-8-7-11(3)9-13(12)15/h7-10,14,17H,4-6,16H2,1-3H3
InChIKeyMSUPODJLKOFGRK-UHFFFAOYSA-N
XLogP4.09
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.26
LogP ≤ 54.09
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-(2-bromo-5-methylphenyl)-4-methylpentyl]hydrazine
CID 105294292
1-(2-bromo-4-methylphenyl)pent-4-enylhydrazine
CID 105311522
[1-(2-bromo-4-methylphenyl)-2-(4-bromophenyl)ethyl]hydrazine
CID 105284383
1-(2-bromo-4-methylphenyl)-N-methylundecan-1-amine
CID 115845869
[1-(2,6-dimethyl-3-pyridinyl)-5-methylhexyl]hydrazine
CID 105331247
1-(2-bromo-4-methylphenyl)-N-methylpropan-1-amine
CID 114979523
[1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine
CID 105285025
[1-(2-bromo-4-methylphenyl)-2-cyclopentylethyl]hydrazine
CID 105299035
1-(2-bromo-4-methylphenyl)-N,3,5-trimethylhexan-1-amine
CID 114201075
[1-(2-bromo-4-methylphenyl)-2-propoxyethyl]hydrazine
CID 105321406
[5-methyl-1-(4-methyl-3-pyridinyl)hexyl]hydrazine
CID 105279962
3-[2-(2-bromo-4-methylphenyl)-2-hydrazinylethyl]pyridin-4-amine
CID 114015578

Frequently Asked Questions

What is the IUPAC name of [1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine?
The IUPAC name of [1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine (CID 105331264) is [1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine.
What is the SMILES notation for [1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine?
The canonical SMILES for [1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine is Cc1ccc(C(CCCC(C)C)NN)c(Br)c1.
What is the InChIKey of [1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine?
The InChIKey is MSUPODJLKOFGRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23BrN2/c1-10(2)5-4-6-14(17-16)12-8-7-11(3)9-13(12)15/h7-10,14,17H,4-6,16H2,1-3H3.
What are the key properties of [1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine?
[1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine has a molecular weight of 299.26 g/mol, XLogP of 4.09, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromo-4-methylphenyl)-5-methylhexyl]hydrazine is sourced from PubChem (CID 105331264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).