[2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine

C14H17N7 — CID 105291066

IUPAC[2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine
SMILESCn1cc(CC(NN)c2cnn(-c3ccccc3)n2)cn1
InChIInChI=1S/C14H17N7/c1-20-10-11(8-16-20)7-13(18-15)14-9-17-21(19-14)12-5-3-2-4-6-12/h2-6,8-10,13,18H,7,15H2,1H3
InChIKeyCQLVQEFOXYSLDM-UHFFFAOYSA-N
MW283.34 g/mol
LogP0.75
Rot. Bonds5

About [2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine

[2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine (PubChem CID 105291066) has the molecular formula C14H17N7 and a molecular weight of 283.34 g/mol. Its IUPAC name is [2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine
PubChem CID105291066
Molecular FormulaC14H17N7
Molecular Weight283.34 g/mol
Exact Mass283.15
IUPAC Name[2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine
SMILESCn1cc(CC(NN)c2cnn(-c3ccccc3)n2)cn1
InChIInChI=1S/C14H17N7/c1-20-10-11(8-16-20)7-13(18-15)14-9-17-21(19-14)12-5-3-2-4-6-12/h2-6,8-10,13,18H,7,15H2,1H3
InChIKeyCQLVQEFOXYSLDM-UHFFFAOYSA-N
XLogP0.75
TPSA86.58 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.34
LogP ≤ 50.75
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

3-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)propan-1-amine
CID 103030204
[2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine
CID 107066810
[1-(1-methylpyrazol-3-yl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105228732
[3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine
CID 105298472
1,2-bis(1-methylpyrazol-4-yl)ethylhydrazine
CID 105228414
1-(1-methylpyrazol-4-yl)-N-[(2-phenyltriazol-4-yl)methyl]methanamine
CID 61350413
[2-(1-methylpyrazol-4-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethyl]hydrazine
CID 105291161
2-(1-methyltriazol-4-yl)-1-(2-phenyltriazol-4-yl)ethanol
CID 107065645
[2-(1-methylpyrazol-4-yl)-1-(4-methylthiophen-3-yl)ethyl]hydrazine
CID 105251829
[1-(6-chloro-3-pyridinyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105253076
[1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105191715
[1-(2-ethyl-5-methylpyrazol-3-yl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105291184

Frequently Asked Questions

What is the IUPAC name of [2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine?
The IUPAC name of [2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine (CID 105291066) is [2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine?
The canonical SMILES for [2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine is Cn1cc(CC(NN)c2cnn(-c3ccccc3)n2)cn1.
What is the InChIKey of [2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine?
The InChIKey is CQLVQEFOXYSLDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N7/c1-20-10-11(8-16-20)7-13(18-15)14-9-17-21(19-14)12-5-3-2-4-6-12/h2-6,8-10,13,18H,7,15H2,1H3.
What are the key properties of [2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine?
[2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine has a molecular weight of 283.34 g/mol, XLogP of 0.75, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105291066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).