1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine

C11H15BrN4 — CID 170348104

IUPAC1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine
SMILESCNNC1=Nc2cccc(Br)c2N(C)C1C
InChIInChI=1S/C11H15BrN4/c1-7-11(15-13-2)14-9-6-4-5-8(12)10(9)16(7)3/h4-7,13H,1-3H3,(H,14,15)
InChIKeyNOQHPQDEOZZNSC-UHFFFAOYSA-N
MW283.17 g/mol
LogP2.04
Rot. Bonds1

About 1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine

1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine (PubChem CID 170348104) has the molecular formula C11H15BrN4 and a molecular weight of 283.17 g/mol. Its IUPAC name is 1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine.

Molecular Properties

Compound Name1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine
PubChem CID170348104
Molecular FormulaC11H15BrN4
Molecular Weight283.17 g/mol
Exact Mass282.05
IUPAC Name1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine
SMILESCNNC1=Nc2cccc(Br)c2N(C)C1C
InChIInChI=1S/C11H15BrN4/c1-7-11(15-13-2)14-9-6-4-5-8(12)10(9)16(7)3/h4-7,13H,1-3H3,(H,14,15)
InChIKeyNOQHPQDEOZZNSC-UHFFFAOYSA-N
XLogP2.04
TPSA39.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.17
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine?
The IUPAC name of 1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine (CID 170348104) is 1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine.
What is the SMILES notation for 1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine?
The canonical SMILES for 1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine is CNNC1=Nc2cccc(Br)c2N(C)C1C.
What is the InChIKey of 1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine?
The InChIKey is NOQHPQDEOZZNSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN4/c1-7-11(15-13-2)14-9-6-4-5-8(12)10(9)16(7)3/h4-7,13H,1-3H3,(H,14,15).
What are the key properties of 1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine?
1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine has a molecular weight of 283.17 g/mol, XLogP of 2.04, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine is sourced from PubChem (CID 170348104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).