[1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine

C11H15BrN6 — CID 106466500

IUPAC[1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine
SMILESCn1nnc(Br)c1C(CCc1ccncc1)NN
InChIInChI=1S/C11H15BrN6/c1-18-10(11(12)16-17-18)9(15-13)3-2-8-4-6-14-7-5-8/h4-7,9,15H,2-3,13H2,1H3
InChIKeyRLBQTZQXFDGBPD-UHFFFAOYSA-N
MW311.19 g/mol
LogP1.11
Rot. Bonds5

About [1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine

[1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine (PubChem CID 106466500) has the molecular formula C11H15BrN6 and a molecular weight of 311.19 g/mol. Its IUPAC name is [1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine.

Molecular Properties

Compound Name[1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine
PubChem CID106466500
Molecular FormulaC11H15BrN6
Molecular Weight311.19 g/mol
Exact Mass310.05
IUPAC Name[1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine
SMILESCn1nnc(Br)c1C(CCc1ccncc1)NN
InChIInChI=1S/C11H15BrN6/c1-18-10(11(12)16-17-18)9(15-13)3-2-8-4-6-14-7-5-8/h4-7,9,15H,2-3,13H2,1H3
InChIKeyRLBQTZQXFDGBPD-UHFFFAOYSA-N
XLogP1.11
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.19
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-(5-bromo-3-methyltriazol-4-yl)-4-thiophen-2-ylbutyl]hydrazine
CID 106466584
3-(5-bromo-3-methyltriazol-4-yl)-N,N-diethyl-3-hydrazinylpropan-1-amine
CID 106466087
[1-(5-bromo-3-methyltriazol-4-yl)-2-(4-methoxyphenyl)ethyl]hydrazine
CID 106465858
[1-(5-bromo-3-methyltriazol-4-yl)-3-(2,2-difluoroethoxy)propyl]hydrazine
CID 106466287
[1-(5-bromo-3-methyltriazol-4-yl)-2-[(2-methylpropan-2-yl)oxy]ethyl]hydrazine
CID 106466600
1-(5-bromo-3-methyltriazol-4-yl)-N-methyl-3-pyridin-2-ylpropan-1-amine
CID 106465261
[1-(4-methyl-3-pyridinyl)-3-pyridin-4-ylpropyl]hydrazine
CID 105320620
[1-(3-bromothiophen-2-yl)-3-pyridin-4-ylpropyl]hydrazine
CID 105327947
1-(5-bromo-3-methyltriazol-4-yl)ethylhydrazine
CID 106465831
[1-(5-bromo-3-methyltriazol-4-yl)-3-(oxan-2-yl)propyl]hydrazine
CID 106466425
1-(4-bromo-1-methylpyrazol-5-yl)-N-propyl-3-pyridin-4-ylpropan-1-amine
CID 105189818
[1-(2,3-dimethylphenyl)-3-pyridin-4-ylpropyl]hydrazine
CID 105300607

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine?
The IUPAC name of [1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine (CID 106466500) is [1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine.
What is the SMILES notation for [1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine?
The canonical SMILES for [1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine is Cn1nnc(Br)c1C(CCc1ccncc1)NN.
What is the InChIKey of [1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine?
The InChIKey is RLBQTZQXFDGBPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN6/c1-18-10(11(12)16-17-18)9(15-13)3-2-8-4-6-14-7-5-8/h4-7,9,15H,2-3,13H2,1H3.
What are the key properties of [1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine?
[1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine has a molecular weight of 311.19 g/mol, XLogP of 1.11, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromo-3-methyltriazol-4-yl)-3-pyridin-4-ylpropyl]hydrazine is sourced from PubChem (CID 106466500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).