7-bromo-8-methoxyquinoxalin-2-amine

C9H8BrN3O — CID 170365318

IUPAC7-bromo-8-methoxyquinoxalin-2-amine
SMILESCOc1c(Br)ccc2ncc(N)nc12
InChIInChI=1S/C9H8BrN3O/c1-14-9-5(10)2-3-6-8(9)13-7(11)4-12-6/h2-4H,1H3,(H2,11,13)
InChIKeyRHBFFJQXMCKNDN-UHFFFAOYSA-N
MW254.09 g/mol
LogP1.98
Rot. Bonds1

About 7-bromo-8-methoxyquinoxalin-2-amine

7-bromo-8-methoxyquinoxalin-2-amine (PubChem CID 170365318) has the molecular formula C9H8BrN3O and a molecular weight of 254.09 g/mol. Its IUPAC name is 7-bromo-8-methoxyquinoxalin-2-amine.

Molecular Properties

Compound Name7-bromo-8-methoxyquinoxalin-2-amine
PubChem CID170365318
Molecular FormulaC9H8BrN3O
Molecular Weight254.09 g/mol
Exact Mass252.99
IUPAC Name7-bromo-8-methoxyquinoxalin-2-amine
SMILESCOc1c(Br)ccc2ncc(N)nc12
InChIInChI=1S/C9H8BrN3O/c1-14-9-5(10)2-3-6-8(9)13-7(11)4-12-6/h2-4H,1H3,(H2,11,13)
InChIKeyRHBFFJQXMCKNDN-UHFFFAOYSA-N
XLogP1.98
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.09
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-8-methoxyquinoxalin-2-amine?
The IUPAC name of 7-bromo-8-methoxyquinoxalin-2-amine (CID 170365318) is 7-bromo-8-methoxyquinoxalin-2-amine.
What is the SMILES notation for 7-bromo-8-methoxyquinoxalin-2-amine?
The canonical SMILES for 7-bromo-8-methoxyquinoxalin-2-amine is COc1c(Br)ccc2ncc(N)nc12.
What is the InChIKey of 7-bromo-8-methoxyquinoxalin-2-amine?
The InChIKey is RHBFFJQXMCKNDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8BrN3O/c1-14-9-5(10)2-3-6-8(9)13-7(11)4-12-6/h2-4H,1H3,(H2,11,13).
What are the key properties of 7-bromo-8-methoxyquinoxalin-2-amine?
7-bromo-8-methoxyquinoxalin-2-amine has a molecular weight of 254.09 g/mol, XLogP of 1.98, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-8-methoxyquinoxalin-2-amine is sourced from PubChem (CID 170365318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).