5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine

C10H10Br2N4 — CID 164530828

IUPAC5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine
SMILESCc1nc2c(Br)c(N)c(N)c(Br)c2nc1C
InChIInChI=1S/C10H10Br2N4/c1-3-4(2)16-10-6(12)8(14)7(13)5(11)9(10)15-3/h13-14H2,1-2H3
InChIKeyAIYCULIZSZINBT-UHFFFAOYSA-N
MW346.03 g/mol
LogP2.94
Rot. Bonds

About 5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine

5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine (PubChem CID 164530828) has the molecular formula C10H10Br2N4 and a molecular weight of 346.03 g/mol. Its IUPAC name is 5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine.

Molecular Properties

Compound Name5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine
PubChem CID164530828
Molecular FormulaC10H10Br2N4
Molecular Weight346.03 g/mol
Exact Mass343.93
IUPAC Name5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine
SMILESCc1nc2c(Br)c(N)c(N)c(Br)c2nc1C
InChIInChI=1S/C10H10Br2N4/c1-3-4(2)16-10-6(12)8(14)7(13)5(11)9(10)15-3/h13-14H2,1-2H3
InChIKeyAIYCULIZSZINBT-UHFFFAOYSA-N
XLogP2.94
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.03
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-bromo-4,6-dimethylpyridine-2,3-diamine
CID 15827793
2,6-dimethylpyridine-3,4,5-triamine
CID 21436310
2,4,6-tribromo-5-methylbenzene-1,3-diamine
CID 157076540
5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine
CID 107925692
4-(4-bromo-3,5-dimethylpyrazol-1-yl)-2-chloro-6-methylpyrimidin-5-amine
CID 114044042
6-bromo-8-ethyl-2,3-dimethylquinolin-4-amine
CID 81289001
2,3,5,6-tetramethylpyrazine;trihydrate
CID 66732985
2,3,5,7-tetramethylselenopheno[3,4-b]pyrazine
CID 59944182
3-bromo-2-methylquinolin-4-amine;hydrochloride
CID 3022129
8-bromo-2,6-dimethyl-3-propan-2-ylquinolin-4-amine
CID 62914764
3-bromo-2,4,6-trifluoro-5-methylaniline
CID 77134473
4,6,7-tribromo-2H-benzotriazol-5-amine
CID 102043777

Frequently Asked Questions

What is the IUPAC name of 5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine?
The IUPAC name of 5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine (CID 164530828) is 5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine.
What is the SMILES notation for 5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine?
The canonical SMILES for 5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine is Cc1nc2c(Br)c(N)c(N)c(Br)c2nc1C.
What is the InChIKey of 5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine?
The InChIKey is AIYCULIZSZINBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Br2N4/c1-3-4(2)16-10-6(12)8(14)7(13)5(11)9(10)15-3/h13-14H2,1-2H3.
What are the key properties of 5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine?
5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine has a molecular weight of 346.03 g/mol, XLogP of 2.94, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-dibromo-2,3-dimethylquinoxaline-6,7-diamine is sourced from PubChem (CID 164530828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).