[(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine

C8H10BrN5O — CID 105337692

IUPAC[(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine
SMILESCn1nncc1C(NN)c1ccc(Br)o1
InChIInChI=1S/C8H10BrN5O/c1-14-5(4-11-13-14)8(12-10)6-2-3-7(9)15-6/h2-4,8,12H,10H2,1H3
InChIKeyMNMNOAYBARQPLX-UHFFFAOYSA-N
MW272.11 g/mol
LogP0.72
Rot. Bonds3

About [(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine

[(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine (PubChem CID 105337692) has the molecular formula C8H10BrN5O and a molecular weight of 272.11 g/mol. Its IUPAC name is [(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine
PubChem CID105337692
Molecular FormulaC8H10BrN5O
Molecular Weight272.11 g/mol
Exact Mass271.01
IUPAC Name[(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine
SMILESCn1nncc1C(NN)c1ccc(Br)o1
InChIInChI=1S/C8H10BrN5O/c1-14-5(4-11-13-14)8(12-10)6-2-3-7(9)15-6/h2-4,8,12H,10H2,1H3
InChIKeyMNMNOAYBARQPLX-UHFFFAOYSA-N
XLogP0.72
TPSA81.90 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.11
LogP ≤ 50.72
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

N-[(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]ethanamine
CID 105043781
[(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105307526
[(2-methylpyrazol-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337508
[(5-bromo-2-methylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337546
[(3-methyltriazol-4-yl)-pyridin-4-ylmethyl]hydrazine
CID 105196426
[(2-bromo-5-fluorophenyl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337670
N-[(5-bromofuran-2-yl)-(3-propyltriazol-4-yl)methyl]ethanamine
CID 105038850
[(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337530
[(4-methylsulfanylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337638
[(3-bromoquinolin-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105257271
[(2-methoxy-4-methylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 106794066
[(2-ethylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337685

Frequently Asked Questions

What is the IUPAC name of [(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine?
The IUPAC name of [(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine (CID 105337692) is [(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine?
The canonical SMILES for [(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine is Cn1nncc1C(NN)c1ccc(Br)o1.
What is the InChIKey of [(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine?
The InChIKey is MNMNOAYBARQPLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10BrN5O/c1-14-5(4-11-13-14)8(12-10)6-2-3-7(9)15-6/h2-4,8,12H,10H2,1H3.
What are the key properties of [(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine?
[(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine has a molecular weight of 272.11 g/mol, XLogP of 0.72, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 105337692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).