[2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine

C11H14BrN5 — CID 105195498

IUPAC[2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine
SMILESCn1nncc1C(Cc1ccc(Br)cc1)NN
InChIInChI=1S/C11H14BrN5/c1-17-11(7-14-16-17)10(15-13)6-8-2-4-9(12)5-3-8/h2-5,7,10,15H,6,13H2,1H3
InChIKeyMMXQTKUHFYMOIV-UHFFFAOYSA-N
MW296.17 g/mol
LogP1.32
Rot. Bonds4

About [2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine

[2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine (PubChem CID 105195498) has the molecular formula C11H14BrN5 and a molecular weight of 296.17 g/mol. Its IUPAC name is [2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine
PubChem CID105195498
Molecular FormulaC11H14BrN5
Molecular Weight296.17 g/mol
Exact Mass295.04
IUPAC Name[2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine
SMILESCn1nncc1C(Cc1ccc(Br)cc1)NN
InChIInChI=1S/C11H14BrN5/c1-17-11(7-14-16-17)10(15-13)6-8-2-4-9(12)5-3-8/h2-5,7,10,15H,6,13H2,1H3
InChIKeyMMXQTKUHFYMOIV-UHFFFAOYSA-N
XLogP1.32
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.17
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-methyltriazol-4-yl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105337598
[2-(3,5-difluorophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine
CID 105206647
[3,3-dimethyl-1-(3-methyltriazol-4-yl)butyl]hydrazine
CID 105220254
N-[2-(4-methylphenyl)-1-(3-methyltriazol-4-yl)ethyl]propan-1-amine
CID 114687476
1,2-bis(4-bromophenyl)ethylhydrazine
CID 105192515
1-(3-methyltriazol-4-yl)hexylhydrazine
CID 105337497
[2-(2-chloro-4-fluorophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine
CID 105216120
[2-(2-methylphenyl)sulfanyl-1-(3-methyltriazol-4-yl)ethyl]hydrazine
CID 105237364
1-(3-methyltriazol-4-yl)dodecylhydrazine
CID 105337498
[(5-bromo-2-methylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337546
[1-(2-bromo-4-methylphenyl)-2-(4-bromophenyl)ethyl]hydrazine
CID 105284383
2-(3,5-dimethylphenyl)-N-methyl-1-(3-methyltriazol-4-yl)ethanamine
CID 114687515

Frequently Asked Questions

What is the IUPAC name of [2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine?
The IUPAC name of [2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine (CID 105195498) is [2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine?
The canonical SMILES for [2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine is Cn1nncc1C(Cc1ccc(Br)cc1)NN.
What is the InChIKey of [2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine?
The InChIKey is MMXQTKUHFYMOIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrN5/c1-17-11(7-14-16-17)10(15-13)6-8-2-4-9(12)5-3-8/h2-5,7,10,15H,6,13H2,1H3.
What are the key properties of [2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine?
[2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine has a molecular weight of 296.17 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-bromophenyl)-1-(3-methyltriazol-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105195498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).