1-(5-bromo-2-methylphenyl)butylhydrazine

C11H17BrN2 — CID 105282216

IUPAC1-(5-bromo-2-methylphenyl)butylhydrazine
SMILESCCCC(NN)c1cc(Br)ccc1C
InChIInChI=1S/C11H17BrN2/c1-3-4-11(14-13)10-7-9(12)6-5-8(10)2/h5-7,11,14H,3-4,13H2,1-2H3
InChIKeyDURQETNYCKAFFY-UHFFFAOYSA-N
MW257.17 g/mol
LogP3.06
Rot. Bonds4

About 1-(5-bromo-2-methylphenyl)butylhydrazine

1-(5-bromo-2-methylphenyl)butylhydrazine (PubChem CID 105282216) has the molecular formula C11H17BrN2 and a molecular weight of 257.17 g/mol. Its IUPAC name is 1-(5-bromo-2-methylphenyl)butylhydrazine.

Molecular Properties

Compound Name1-(5-bromo-2-methylphenyl)butylhydrazine
PubChem CID105282216
Molecular FormulaC11H17BrN2
Molecular Weight257.17 g/mol
Exact Mass256.06
IUPAC Name1-(5-bromo-2-methylphenyl)butylhydrazine
SMILESCCCC(NN)c1cc(Br)ccc1C
InChIInChI=1S/C11H17BrN2/c1-3-4-11(14-13)10-7-9(12)6-5-8(10)2/h5-7,11,14H,3-4,13H2,1-2H3
InChIKeyDURQETNYCKAFFY-UHFFFAOYSA-N
XLogP3.06
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.17
LogP ≤ 53.06
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-(2,5-dibromophenyl)pentylhydrazine
CID 105293801
1-(4-bromo-2-methylphenyl)undecylhydrazine
CID 105298297
1-(4-bromo-2-methylphenyl)octylhydrazine
CID 105293450
[2-(4-bromo-2-fluorophenyl)-1-(5-bromo-2-methylphenyl)ethyl]hydrazine
CID 105297391
[1-(5-bromo-2-methylphenyl)-2-pyridin-4-ylethyl]hydrazine
CID 105317484
1-(5-bromo-2-methylphenyl)-N-methylheptan-1-amine
CID 115833849
4-bromo-2-(1-hydrazinyloctyl)aniline
CID 105263445
[1-(5-bromo-2-methylphenyl)-2-(furan-2-yl)ethyl]hydrazine
CID 105331504
[1-(5-bromo-2-methylphenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine
CID 106868638
[1-(5-bromo-2-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine
CID 105291814
1-(5-bromo-2-methylphenyl)octan-1-ol
CID 115783049
1-(5-bromo-2-methylphenyl)decan-1-ol
CID 115782829

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-2-methylphenyl)butylhydrazine?
The IUPAC name of 1-(5-bromo-2-methylphenyl)butylhydrazine (CID 105282216) is 1-(5-bromo-2-methylphenyl)butylhydrazine.
What is the SMILES notation for 1-(5-bromo-2-methylphenyl)butylhydrazine?
The canonical SMILES for 1-(5-bromo-2-methylphenyl)butylhydrazine is CCCC(NN)c1cc(Br)ccc1C.
What is the InChIKey of 1-(5-bromo-2-methylphenyl)butylhydrazine?
The InChIKey is DURQETNYCKAFFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17BrN2/c1-3-4-11(14-13)10-7-9(12)6-5-8(10)2/h5-7,11,14H,3-4,13H2,1-2H3.
What are the key properties of 1-(5-bromo-2-methylphenyl)butylhydrazine?
1-(5-bromo-2-methylphenyl)butylhydrazine has a molecular weight of 257.17 g/mol, XLogP of 3.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-2-methylphenyl)butylhydrazine is sourced from PubChem (CID 105282216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).