(6,7-dimethylquinoxalin-2-yl)methanamine

C11H13N3 — CID 117274840

IUPAC(6,7-dimethylquinoxalin-2-yl)methanamine
SMILESCc1cc2ncc(CN)nc2cc1C
InChIInChI=1S/C11H13N3/c1-7-3-10-11(4-8(7)2)14-9(5-12)6-13-10/h3-4,6H,5,12H2,1-2H3
InChIKeyWQGKTWUOOZJONJ-UHFFFAOYSA-N
MW187.25 g/mol
LogP1.71
Rot. Bonds1

About (6,7-dimethylquinoxalin-2-yl)methanamine

(6,7-dimethylquinoxalin-2-yl)methanamine (PubChem CID 117274840) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is (6,7-dimethylquinoxalin-2-yl)methanamine.

Molecular Properties

Compound Name(6,7-dimethylquinoxalin-2-yl)methanamine
PubChem CID117274840
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name(6,7-dimethylquinoxalin-2-yl)methanamine
SMILESCc1cc2ncc(CN)nc2cc1C
InChIInChI=1S/C11H13N3/c1-7-3-10-11(4-8(7)2)14-9(5-12)6-13-10/h3-4,6H,5,12H2,1-2H3
InChIKeyWQGKTWUOOZJONJ-UHFFFAOYSA-N
XLogP1.71
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (6,7-dimethylquinoxalin-2-yl)methanamine?
The IUPAC name of (6,7-dimethylquinoxalin-2-yl)methanamine (CID 117274840) is (6,7-dimethylquinoxalin-2-yl)methanamine.
What is the SMILES notation for (6,7-dimethylquinoxalin-2-yl)methanamine?
The canonical SMILES for (6,7-dimethylquinoxalin-2-yl)methanamine is Cc1cc2ncc(CN)nc2cc1C.
What is the InChIKey of (6,7-dimethylquinoxalin-2-yl)methanamine?
The InChIKey is WQGKTWUOOZJONJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-7-3-10-11(4-8(7)2)14-9(5-12)6-13-10/h3-4,6H,5,12H2,1-2H3.
What are the key properties of (6,7-dimethylquinoxalin-2-yl)methanamine?
(6,7-dimethylquinoxalin-2-yl)methanamine has a molecular weight of 187.25 g/mol, XLogP of 1.71, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6,7-dimethylquinoxalin-2-yl)methanamine is sourced from PubChem (CID 117274840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).