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

C12H17N5 — CID 105337685

IUPAC[(2-ethylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine
SMILESCCc1ccccc1C(NN)c1cnnn1C
InChIInChI=1S/C12H17N5/c1-3-9-6-4-5-7-10(9)12(15-13)11-8-14-16-17(11)2/h4-8,12,15H,3,13H2,1-2H3
InChIKeyNZYXAEGCEIQDTN-UHFFFAOYSA-N
MW231.30 g/mol
LogP0.93
Rot. Bonds4

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

[(2-ethylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine (PubChem CID 105337685) has the molecular formula C12H17N5 and a molecular weight of 231.30 g/mol. Its IUPAC name is [(2-ethylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-ethylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine
PubChem CID105337685
Molecular FormulaC12H17N5
Molecular Weight231.30 g/mol
Exact Mass231.15
IUPAC Name[(2-ethylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine
SMILESCCc1ccccc1C(NN)c1cnnn1C
InChIInChI=1S/C12H17N5/c1-3-9-6-4-5-7-10(9)12(15-13)11-8-14-16-17(11)2/h4-8,12,15H,3,13H2,1-2H3
InChIKeyNZYXAEGCEIQDTN-UHFFFAOYSA-N
XLogP0.93
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 50.93
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

[(3-methyltriazol-4-yl)-pyrazolo[1,5-a]pyridin-3-ylmethyl]hydrazine
CID 103129959
[(2-methylpyrazol-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337508
[(3-methyltriazol-4-yl)-pyridin-4-ylmethyl]hydrazine
CID 105196426
[(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337530
[(1,3-diethylpyrazol-5-yl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337585
[(3-methyl-2-pyridinyl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105209169
[(4-methylthiophen-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105251742
[(5-bromo-2-methylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337546
[(4-methylsulfanylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337638
[(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337692
[(2-ethylphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 105288198
[(2-bromo-5-fluorophenyl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337670

Frequently Asked Questions

What is the IUPAC name of [(2-ethylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine?
The IUPAC name of [(2-ethylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine (CID 105337685) is [(2-ethylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [(2-ethylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine?
The canonical SMILES for [(2-ethylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine is CCc1ccccc1C(NN)c1cnnn1C.
What is the InChIKey of [(2-ethylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine?
The InChIKey is NZYXAEGCEIQDTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5/c1-3-9-6-4-5-7-10(9)12(15-13)11-8-14-16-17(11)2/h4-8,12,15H,3,13H2,1-2H3.
What are the key properties of [(2-ethylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine?
[(2-ethylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine has a molecular weight of 231.30 g/mol, XLogP of 0.93, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-ethylphenyl)-(3-methyltriazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 105337685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).