[2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine

C12H15N9 — CID 107066810

IUPAC[2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine
SMILESCn1nnc(CC(NN)c2cnn(-c3ccccc3)n2)n1
InChIInChI=1S/C12H15N9/c1-20-18-12(16-19-20)7-10(15-13)11-8-14-21(17-11)9-5-3-2-4-6-9/h2-6,8,10,15H,7,13H2,1H3
InChIKeyDYKBTPDVQGHCLZ-UHFFFAOYSA-N
MW285.32 g/mol
LogP-0.46
Rot. Bonds5

About [2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine

[2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine (PubChem CID 107066810) has the molecular formula C12H15N9 and a molecular weight of 285.32 g/mol. Its IUPAC name is [2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine
PubChem CID107066810
Molecular FormulaC12H15N9
Molecular Weight285.32 g/mol
Exact Mass285.15
IUPAC Name[2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine
SMILESCn1nnc(CC(NN)c2cnn(-c3ccccc3)n2)n1
InChIInChI=1S/C12H15N9/c1-20-18-12(16-19-20)7-10(15-13)11-8-14-21(17-11)9-5-3-2-4-6-9/h2-6,8,10,15H,7,13H2,1H3
InChIKeyDYKBTPDVQGHCLZ-UHFFFAOYSA-N
XLogP-0.46
TPSA112.36 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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

[2-(1-methylpyrazol-4-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine
CID 105291066
[2-(2-methyltetrazol-5-yl)-1-(2H-triazol-4-yl)ethyl]hydrazine
CID 107066305
[3-methyl-1-(2-phenyltriazol-4-yl)pentyl]hydrazine
CID 105298472
[2-(2-methyltetrazol-5-yl)-1-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 107066800
N,5-dimethyl-1-(2-phenyltriazol-4-yl)hexan-1-amine
CID 105177169
2-(1-methyltriazol-4-yl)-1-(2-phenyltriazol-4-yl)ethanol
CID 107065645
[2-(2-methyltetrazol-5-yl)-1-quinolin-4-ylethyl]hydrazine
CID 107066899
[(2-phenyltriazol-4-yl)-pyrimidin-5-ylmethyl]hydrazine
CID 105292082
[(1-methylimidazol-2-yl)-(2-phenyltriazol-4-yl)methyl]hydrazine
CID 105308192
[1-(3,5-dimethyl-2-pyridinyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
CID 107066382
[1-(5-bromothiophen-2-yl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
CID 107066094
[1-(5-bromo-2-chlorophenyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
CID 107066756

Frequently Asked Questions

What is the IUPAC name of [2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine?
The IUPAC name of [2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine (CID 107066810) is [2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine is Cn1nnc(CC(NN)c2cnn(-c3ccccc3)n2)n1.
What is the InChIKey of [2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine?
The InChIKey is DYKBTPDVQGHCLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N9/c1-20-18-12(16-19-20)7-10(15-13)11-8-14-21(17-11)9-5-3-2-4-6-9/h2-6,8,10,15H,7,13H2,1H3.
What are the key properties of [2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine?
[2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine has a molecular weight of 285.32 g/mol, XLogP of -0.46, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methyltetrazol-5-yl)-1-(2-phenyltriazol-4-yl)ethyl]hydrazine is sourced from PubChem (CID 107066810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).