[1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine

C12H18N6O — CID 112744345

IUPAC[1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
SMILESCCn1ncnc1C(Cc1ccc(OC)nc1)NN
InChIInChI=1S/C12H18N6O/c1-3-18-12(15-8-16-18)10(17-13)6-9-4-5-11(19-2)14-7-9/h4-5,7-8,10,17H,3,6,13H2,1-2H3
InChIKeyYYJSKDMGZXNTKT-UHFFFAOYSA-N
MW262.32 g/mol
LogP0.45
Rot. Bonds6

About [1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine

[1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine (PubChem CID 112744345) has the molecular formula C12H18N6O and a molecular weight of 262.32 g/mol. Its IUPAC name is [1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
PubChem CID112744345
Molecular FormulaC12H18N6O
Molecular Weight262.32 g/mol
Exact Mass262.15
IUPAC Name[1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
SMILESCCn1ncnc1C(Cc1ccc(OC)nc1)NN
InChIInChI=1S/C12H18N6O/c1-3-18-12(15-8-16-18)10(17-13)6-9-4-5-11(19-2)14-7-9/h4-5,7-8,10,17H,3,6,13H2,1-2H3
InChIKeyYYJSKDMGZXNTKT-UHFFFAOYSA-N
XLogP0.45
TPSA90.88 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.32
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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-(4-chloro-1-ethylpyrazol-5-yl)-N-ethyl-2-(6-methoxy-3-pyridinyl)ethanamine
CID 114658220
[1-(6-methoxy-3-pyridinyl)-3-methylbutan-2-yl]hydrazine
CID 105250512
[1-(3,4-dimethylphenyl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105250580
[1-(cyclohexen-1-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
CID 106649305
1-(4-bromo-1-ethylpyrazol-5-yl)-2-(6-methoxy-3-pyridinyl)ethanol
CID 114644859
[2-(6-methoxy-3-pyridinyl)-1-(2-methylthiophen-3-yl)ethyl]hydrazine
CID 102842939
[1-(2,4-dimethylphenyl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105250487
[2-(6-methoxy-3-pyridinyl)-1-(5-methyl-3-pyridinyl)ethyl]hydrazine
CID 105250497
[2-(6-methoxy-3-pyridinyl)-1-(3-propylphenyl)ethyl]hydrazine
CID 105250600
[1-(5-ethylthiophen-2-yl)-3-(6-methoxy-3-pyridinyl)propan-2-yl]hydrazine
CID 105250549
[1-(4-fluoro-2-methylphenyl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105250492
[1-(3,4-dihydro-2H-pyran-6-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine
CID 102650080

Frequently Asked Questions

What is the IUPAC name of [1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine?
The IUPAC name of [1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine (CID 112744345) is [1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine is CCn1ncnc1C(Cc1ccc(OC)nc1)NN.
What is the InChIKey of [1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine?
The InChIKey is YYJSKDMGZXNTKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N6O/c1-3-18-12(15-8-16-18)10(17-13)6-9-4-5-11(19-2)14-7-9/h4-5,7-8,10,17H,3,6,13H2,1-2H3.
What are the key properties of [1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine?
[1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine has a molecular weight of 262.32 g/mol, XLogP of 0.45, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-ethyl-1,2,4-triazol-3-yl)-2-(6-methoxy-3-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 112744345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).