[2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine

C13H15N7 — CID 107357968

IUPAC[2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine
SMILESCn1cc(CC(NN)c2cnc3ccccc3n2)nn1
InChIInChI=1S/C13H15N7/c1-20-8-9(18-19-20)6-12(17-14)13-7-15-10-4-2-3-5-11(10)16-13/h2-5,7-8,12,17H,6,14H2,1H3
InChIKeyPNXVDECJOXBPEO-UHFFFAOYSA-N
MW269.31 g/mol
LogP0.51
Rot. Bonds4

About [2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine

[2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine (PubChem CID 107357968) has the molecular formula C13H15N7 and a molecular weight of 269.31 g/mol. Its IUPAC name is [2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine.

Molecular Properties

Compound Name[2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine
PubChem CID107357968
Molecular FormulaC13H15N7
Molecular Weight269.31 g/mol
Exact Mass269.14
IUPAC Name[2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine
SMILESCn1cc(CC(NN)c2cnc3ccccc3n2)nn1
InChIInChI=1S/C13H15N7/c1-20-8-9(18-19-20)6-12(17-14)13-7-15-10-4-2-3-5-11(10)16-13/h2-5,7-8,12,17H,6,14H2,1H3
InChIKeyPNXVDECJOXBPEO-UHFFFAOYSA-N
XLogP0.51
TPSA94.54 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.31
LogP ≤ 50.51
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

[2-(1-methyltriazol-4-yl)-1-pyridin-2-ylethyl]hydrazine
CID 107065906
[2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-3-yl)ethyl]hydrazine
CID 107066649
[2-(2-fluorophenyl)-1-quinoxalin-2-ylethyl]hydrazine
CID 107357809
(4-methyl-1-quinoxalin-2-ylpentyl)hydrazine
CID 107357839
[2-(1-methyltriazol-4-yl)-1-quinolin-6-ylethyl]hydrazine
CID 107066065
[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-quinoxalin-2-ylethyl]hydrazine
CID 107357927
[1-(4-methoxyphenyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine
CID 107065873
(4,4-dimethyl-1-quinoxalin-2-ylpentyl)hydrazine
CID 107357852
(1-quinoxalin-2-yl-2-thiophen-3-ylethyl)hydrazine
CID 107357846
[2-(5-chlorothiophen-2-yl)-1-quinoxalin-2-ylethyl]hydrazine
CID 107357843
[1-(2,4-dichlorophenyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine
CID 107066602
[2-(1-methyltriazol-4-yl)-1-(thiadiazol-5-yl)ethyl]hydrazine
CID 107066667

Frequently Asked Questions

What is the IUPAC name of [2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine?
The IUPAC name of [2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine (CID 107357968) is [2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine.
What is the SMILES notation for [2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine?
The canonical SMILES for [2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine is Cn1cc(CC(NN)c2cnc3ccccc3n2)nn1.
What is the InChIKey of [2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine?
The InChIKey is PNXVDECJOXBPEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N7/c1-20-8-9(18-19-20)6-12(17-14)13-7-15-10-4-2-3-5-11(10)16-13/h2-5,7-8,12,17H,6,14H2,1H3.
What are the key properties of [2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine?
[2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine has a molecular weight of 269.31 g/mol, XLogP of 0.51, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-methyltriazol-4-yl)-1-quinoxalin-2-ylethyl]hydrazine is sourced from PubChem (CID 107357968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).