2,3,7-trimethylquinoxalin-5-amine

C11H13N3 — CID 154111208

IUPAC2,3,7-trimethylquinoxalin-5-amine
SMILESCc1cc(N)c2nc(C)c(C)nc2c1
InChIInChI=1S/C11H13N3/c1-6-4-9(12)11-10(5-6)13-7(2)8(3)14-11/h4-5H,12H2,1-3H3
InChIKeyMOOIMECXMZREIL-UHFFFAOYSA-N
MW187.25 g/mol
LogP2.14
Rot. Bonds

About 2,3,7-trimethylquinoxalin-5-amine

2,3,7-trimethylquinoxalin-5-amine (PubChem CID 154111208) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 2,3,7-trimethylquinoxalin-5-amine.

Molecular Properties

Compound Name2,3,7-trimethylquinoxalin-5-amine
PubChem CID154111208
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name2,3,7-trimethylquinoxalin-5-amine
SMILESCc1cc(N)c2nc(C)c(C)nc2c1
InChIInChI=1S/C11H13N3/c1-6-4-9(12)11-10(5-6)13-7(2)8(3)14-11/h4-5H,12H2,1-3H3
InChIKeyMOOIMECXMZREIL-UHFFFAOYSA-N
XLogP2.14
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2,3-dimethylquinoxaline-6,7-diamine
CID 11513893
2,4,6-trimethylquinolin-8-amine
CID 21388016
4,6,7-trimethylpteridin-2-amine
CID 23422109
3,6-dimethylacridin-1-amine
CID 87586132
4-methylpyridine-2,6-diamine
CID 3015981
5-(5-fluoro-3,7-dimethylquinoxalin-2-yl)-1H-pyrazol-3-amine
CID 67409709
2,3-dimethylpyrido[3,4-b]pyrazin-7-amine
CID 162530098
2,3-dimethylpyrazino[2,3-b]phenazine
CID 101041837
2-cyclopropyl-6-methyl-1H-benzimidazol-4-amine
CID 83697347
2,3-dimethylquinoline-5,8-diamine
CID 174677847
carbon dioxide;2,6-dimethyl-1,5-naphthyridin-4-amine
CID 123584210
6,7-dimethoxy-2,3,5-trimethylquinoxaline;ethane
CID 142406263

Frequently Asked Questions

What is the IUPAC name of 2,3,7-trimethylquinoxalin-5-amine?
The IUPAC name of 2,3,7-trimethylquinoxalin-5-amine (CID 154111208) is 2,3,7-trimethylquinoxalin-5-amine.
What is the SMILES notation for 2,3,7-trimethylquinoxalin-5-amine?
The canonical SMILES for 2,3,7-trimethylquinoxalin-5-amine is Cc1cc(N)c2nc(C)c(C)nc2c1.
What is the InChIKey of 2,3,7-trimethylquinoxalin-5-amine?
The InChIKey is MOOIMECXMZREIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-6-4-9(12)11-10(5-6)13-7(2)8(3)14-11/h4-5H,12H2,1-3H3.
What are the key properties of 2,3,7-trimethylquinoxalin-5-amine?
2,3,7-trimethylquinoxalin-5-amine has a molecular weight of 187.25 g/mol, XLogP of 2.14, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,7-trimethylquinoxalin-5-amine is sourced from PubChem (CID 154111208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).