1-quinoxalin-6-ylprop-2-ynylhydrazine

C11H10N4 — CID 105221881

IUPAC1-quinoxalin-6-ylprop-2-ynylhydrazine
SMILESC#CC(NN)c1ccc2nccnc2c1
InChIInChI=1S/C11H10N4/c1-2-9(15-12)8-3-4-10-11(7-8)14-6-5-13-10/h1,3-7,9,15H,12H2
InChIKeyLAAUUNXYPBRTBA-UHFFFAOYSA-N
MW198.23 g/mol
LogP0.77
Rot. Bonds2

About 1-quinoxalin-6-ylprop-2-ynylhydrazine

1-quinoxalin-6-ylprop-2-ynylhydrazine (PubChem CID 105221881) has the molecular formula C11H10N4 and a molecular weight of 198.23 g/mol. Its IUPAC name is 1-quinoxalin-6-ylprop-2-ynylhydrazine.

Molecular Properties

Compound Name1-quinoxalin-6-ylprop-2-ynylhydrazine
PubChem CID105221881
Molecular FormulaC11H10N4
Molecular Weight198.23 g/mol
Exact Mass198.09
IUPAC Name1-quinoxalin-6-ylprop-2-ynylhydrazine
SMILESC#CC(NN)c1ccc2nccnc2c1
InChIInChI=1S/C11H10N4/c1-2-9(15-12)8-3-4-10-11(7-8)14-6-5-13-10/h1,3-7,9,15H,12H2
InChIKeyLAAUUNXYPBRTBA-UHFFFAOYSA-N
XLogP0.77
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

[cyclobutyl(quinoxalin-6-yl)methyl]hydrazine
CID 105221961
(2-ethyl-1-quinoxalin-6-ylbutyl)hydrazine
CID 105221816
[quinoxalin-6-yl(thiophen-3-yl)methyl]hydrazine
CID 105221830
1-(3-chlorophenyl)prop-2-ynylhydrazine
CID 105194623
1-(4-tert-butylphenyl)prop-2-ynylhydrazine
CID 105315640
[(2,5-difluorophenyl)-quinoxalin-6-ylmethyl]hydrazine
CID 105221888
1-(4-fluoro-3-methoxyphenyl)prop-2-ynylhydrazine
CID 105315530
1-(3,5-dimethylphenyl)prop-2-ynylhydrazine
CID 105315594
(3R)-3-amino-3-quinoxalin-6-ylpropanenitrile
CID 55276938
(4-methoxy-4-methyl-1-quinoxalin-6-ylpentyl)hydrazine
CID 103026296
1-(3-propoxyphenyl)prop-2-ynylhydrazine
CID 105315638
[2-(5-bromo-3-pyridinyl)-1-quinoxalin-6-ylethyl]hydrazine
CID 105221823

Frequently Asked Questions

What is the IUPAC name of 1-quinoxalin-6-ylprop-2-ynylhydrazine?
The IUPAC name of 1-quinoxalin-6-ylprop-2-ynylhydrazine (CID 105221881) is 1-quinoxalin-6-ylprop-2-ynylhydrazine.
What is the SMILES notation for 1-quinoxalin-6-ylprop-2-ynylhydrazine?
The canonical SMILES for 1-quinoxalin-6-ylprop-2-ynylhydrazine is C#CC(NN)c1ccc2nccnc2c1.
What is the InChIKey of 1-quinoxalin-6-ylprop-2-ynylhydrazine?
The InChIKey is LAAUUNXYPBRTBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4/c1-2-9(15-12)8-3-4-10-11(7-8)14-6-5-13-10/h1,3-7,9,15H,12H2.
What are the key properties of 1-quinoxalin-6-ylprop-2-ynylhydrazine?
1-quinoxalin-6-ylprop-2-ynylhydrazine has a molecular weight of 198.23 g/mol, XLogP of 0.77, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-quinoxalin-6-ylprop-2-ynylhydrazine is sourced from PubChem (CID 105221881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).