1-(4-bromo-3-methylphenyl)ethylhydrazine

C9H13BrN2 — CID 53402303

IUPAC1-(4-bromo-3-methylphenyl)ethylhydrazine
SMILESCc1cc(C(C)NN)ccc1Br
InChIInChI=1S/C9H13BrN2/c1-6-5-8(7(2)12-11)3-4-9(6)10/h3-5,7,12H,11H2,1-2H3
InChIKeyJDNYDHWZRSREPJ-UHFFFAOYSA-N
MW229.12 g/mol
LogP2.28
Rot. Bonds2

About 1-(4-bromo-3-methylphenyl)ethylhydrazine

1-(4-bromo-3-methylphenyl)ethylhydrazine (PubChem CID 53402303) has the molecular formula C9H13BrN2 and a molecular weight of 229.12 g/mol. Its IUPAC name is 1-(4-bromo-3-methylphenyl)ethylhydrazine.

Molecular Properties

Compound Name1-(4-bromo-3-methylphenyl)ethylhydrazine
PubChem CID53402303
Molecular FormulaC9H13BrN2
Molecular Weight229.12 g/mol
Exact Mass228.03
IUPAC Name1-(4-bromo-3-methylphenyl)ethylhydrazine
SMILESCc1cc(C(C)NN)ccc1Br
InChIInChI=1S/C9H13BrN2/c1-6-5-8(7(2)12-11)3-4-9(6)10/h3-5,7,12H,11H2,1-2H3
InChIKeyJDNYDHWZRSREPJ-UHFFFAOYSA-N
XLogP2.28
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.12
LogP ≤ 52.28
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

[(5-bromo-2-fluorophenyl)-(4-bromo-3-methylphenyl)methyl]hydrazine
CID 105323074
1-(3-bromo-4-methoxyphenyl)ethylhydrazine
CID 82478801
1-(4-bromo-3-methylphenyl)but-3-ynylhydrazine
CID 105281427
[(4-bromo-3-methylphenyl)-(2-chloro-5-fluorophenyl)methyl]hydrazine
CID 105398038
5-[1-(4-bromo-3-methylphenyl)ethylamino]-4-methylpentan-2-ol
CID 110010765
(2R)-2-[1-(4-bromo-3-methylphenyl)ethylamino]butan-1-ol
CID 103949550
1-(4-bromo-3-methylphenyl)hex-4-ynylhydrazine
CID 105334894
[1-[1-(4-bromo-3-methylphenyl)ethylamino]cyclopropyl]methanol
CID 115976164
[(4-bromo-3-methylphenyl)-(7-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105338351
[1-(4-bromo-3-methylphenyl)-2-(3,5-difluorophenyl)ethyl]hydrazine
CID 105413062
(1R)-1-(4-bromo-3-methylphenyl)prop-2-en-1-amine
CID 131144021
2-(4-bromo-3-methylphenyl)-2-(propylamino)acetic acid
CID 66480181

Frequently Asked Questions

What is the IUPAC name of 1-(4-bromo-3-methylphenyl)ethylhydrazine?
The IUPAC name of 1-(4-bromo-3-methylphenyl)ethylhydrazine (CID 53402303) is 1-(4-bromo-3-methylphenyl)ethylhydrazine.
What is the SMILES notation for 1-(4-bromo-3-methylphenyl)ethylhydrazine?
The canonical SMILES for 1-(4-bromo-3-methylphenyl)ethylhydrazine is Cc1cc(C(C)NN)ccc1Br.
What is the InChIKey of 1-(4-bromo-3-methylphenyl)ethylhydrazine?
The InChIKey is JDNYDHWZRSREPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13BrN2/c1-6-5-8(7(2)12-11)3-4-9(6)10/h3-5,7,12H,11H2,1-2H3.
What are the key properties of 1-(4-bromo-3-methylphenyl)ethylhydrazine?
1-(4-bromo-3-methylphenyl)ethylhydrazine has a molecular weight of 229.12 g/mol, XLogP of 2.28, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-bromo-3-methylphenyl)ethylhydrazine is sourced from PubChem (CID 53402303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).