(5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine

C9H11BrN4 — CID 170348059

IUPAC(5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine
SMILESCN1CC(NN)=Nc2cccc(Br)c21
InChIInChI=1S/C9H11BrN4/c1-14-5-8(13-11)12-7-4-2-3-6(10)9(7)14/h2-4H,5,11H2,1H3,(H,12,13)
InChIKeyPCYPXQZMLUMHPC-UHFFFAOYSA-N
MW255.12 g/mol
LogP1.39
Rot. Bonds

About (5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine

(5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine (PubChem CID 170348059) has the molecular formula C9H11BrN4 and a molecular weight of 255.12 g/mol. Its IUPAC name is (5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine.

Molecular Properties

Compound Name(5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine
PubChem CID170348059
Molecular FormulaC9H11BrN4
Molecular Weight255.12 g/mol
Exact Mass254.02
IUPAC Name(5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine
SMILESCN1CC(NN)=Nc2cccc(Br)c21
InChIInChI=1S/C9H11BrN4/c1-14-5-8(13-11)12-7-4-2-3-6(10)9(7)14/h2-4H,5,11H2,1H3,(H,12,13)
InChIKeyPCYPXQZMLUMHPC-UHFFFAOYSA-N
XLogP1.39
TPSA53.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.12
LogP ≤ 51.39
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'}

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Related Compounds

1-(5-bromo-7-fluoro-4-methyl-3H-quinoxalin-2-yl)-2-methylhydrazine
CID 164902663
7-Bromo-1-ethanimidoylquinoxalin-2-imine
CID 144344956
(2Z)-5-bromo-2-hydrazinylidene-4-methyl-3H-quinoxalin-1-amine
CID 164902643
1-(5-bromo-3,4-dimethyl-3H-quinoxalin-2-yl)-2-methylhydrazine
CID 170348104
1-(5-bromo-4-methyl-3H-quinoxalin-2-yl)-2-methylhydrazine
CID 170600134
2-[Amino-[3-(methylamino)propyl]amino]-3-bromoaniline
CID 176681300
9-Bromo-1,2,4,5-tetrahydroimidazo[1,2-a]quinoxaline
CID 115046906
3,4-Dihydroquinoxalin-2-ylhydrazine
CID 129321320
1-(3-bromophenyl)-N-methylpyrazolidin-3-imine
CID 136423986
2-[2-Bromo-6-(cyclopropylamino)phenyl]-1-(diaminomethylidene)guanidine
CID 168604894

Frequently Asked Questions

What is the IUPAC name of (5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine?
The IUPAC name of (5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine (CID 170348059) is (5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine.
What is the SMILES notation for (5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine?
The canonical SMILES for (5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine is CN1CC(NN)=Nc2cccc(Br)c21.
What is the InChIKey of (5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine?
The InChIKey is PCYPXQZMLUMHPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11BrN4/c1-14-5-8(13-11)12-7-4-2-3-6(10)9(7)14/h2-4H,5,11H2,1H3,(H,12,13).
What are the key properties of (5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine?
(5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine has a molecular weight of 255.12 g/mol, XLogP of 1.39, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-4-methyl-3H-quinoxalin-2-yl)hydrazine is sourced from PubChem (CID 170348059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).