[1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine

C14H17N5O — CID 105316478

IUPAC[1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine
SMILESCc1ccc2oc(C(Cc3ncnn3C)NN)cc2c1
InChIInChI=1S/C14H17N5O/c1-9-3-4-12-10(5-9)6-13(20-12)11(18-15)7-14-16-8-17-19(14)2/h3-6,8,11,18H,7,15H2,1-2H3
InChIKeyOGUNXSANTFRPBC-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.62
Rot. Bonds4

About [1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine

[1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine (PubChem CID 105316478) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is [1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine
PubChem CID105316478
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name[1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine
SMILESCc1ccc2oc(C(Cc3ncnn3C)NN)cc2c1
InChIInChI=1S/C14H17N5O/c1-9-3-4-12-10(5-9)6-13(20-12)11(18-15)7-14-16-8-17-19(14)2/h3-6,8,11,18H,7,15H2,1-2H3
InChIKeyOGUNXSANTFRPBC-UHFFFAOYSA-N
XLogP1.62
TPSA81.90 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.62
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-(2,4-dimethylphenyl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine
CID 105316455
[1-(5-fluoro-3-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine
CID 105316414
[1-(5-methyl-1-benzofuran-2-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethyl]hydrazine
CID 105214131
[1-(5-methyl-1-benzofuran-2-yl)-2-(2-methylphenyl)ethyl]hydrazine
CID 105208272
[2-(3-bromothiophen-2-yl)-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine
CID 105299502
[(2-ethyl-1,2,4-triazol-3-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 112744358
1-(5-methyl-1-benzofuran-2-yl)but-3-enylhydrazine
CID 105269594
[2-ethoxy-1-(5-methyl-1-benzofuran-2-yl)ethyl]hydrazine
CID 105235203
[1-(3,4-difluorophenyl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine
CID 105197069
[1-(5-methylpyrazin-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine
CID 105316546
[1-(1,3-dimethylpyrazol-4-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine
CID 102805022
4-[1-hydrazinyl-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]-N,N-dimethylaniline
CID 105316424

Frequently Asked Questions

What is the IUPAC name of [1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine?
The IUPAC name of [1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine (CID 105316478) is [1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine?
The canonical SMILES for [1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine is Cc1ccc2oc(C(Cc3ncnn3C)NN)cc2c1.
What is the InChIKey of [1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine?
The InChIKey is OGUNXSANTFRPBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-9-3-4-12-10(5-9)6-13(20-12)11(18-15)7-14-16-8-17-19(14)2/h3-6,8,11,18H,7,15H2,1-2H3.
What are the key properties of [1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine?
[1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine has a molecular weight of 271.32 g/mol, XLogP of 1.62, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-methyl-1-benzofuran-2-yl)-2-(2-methyl-1,2,4-triazol-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105316478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).