7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one

C10H9BrN2O2 — CID 162524476

IUPAC7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one
SMILESCOc1nc2ccc(Br)c(C)c2[nH]c1=O
InChIInChI=1S/C10H9BrN2O2/c1-5-6(11)3-4-7-8(5)13-9(14)10(12-7)15-2/h3-4H,1-2H3,(H,13,14)
InChIKeyHHPOTFYOMCZQGB-UHFFFAOYSA-N
MW269.10 g/mol
LogP2.00
Rot. Bonds1

About 7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one

7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one (PubChem CID 162524476) has the molecular formula C10H9BrN2O2 and a molecular weight of 269.10 g/mol. Its IUPAC name is 7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one.

Molecular Properties

Compound Name7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one
PubChem CID162524476
Molecular FormulaC10H9BrN2O2
Molecular Weight269.10 g/mol
Exact Mass267.98
IUPAC Name7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one
SMILESCOc1nc2ccc(Br)c(C)c2[nH]c1=O
InChIInChI=1S/C10H9BrN2O2/c1-5-6(11)3-4-7-8(5)13-9(14)10(12-7)15-2/h3-4H,1-2H3,(H,13,14)
InChIKeyHHPOTFYOMCZQGB-UHFFFAOYSA-N
XLogP2.00
TPSA54.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.10
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dimethoxy-7,10-dihydropyrazino[2,3-f]quinoxaline-8,9-dione
CID 72723728
3,7-dimethoxy-1H-quinoxalin-2-one
CID 130182707
7-bromo-8-(difluoromethyl)-3-methyl-1H-quinoxalin-2-one
CID 169110496
2-amino-6-bromo-5-methoxy-3H-quinazolin-4-one;trihydrate
CID 137314152
2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one
CID 176774328
2-methoxy-3,5-dihydropyrrolo[3,2-d]pyrimidin-4-one
CID 152647551
azane;3-bromo-2-methoxy-6-methylpyridine
CID 175713094
5-bromo-8-methoxy-1H-3,1-benzoxazine-2,4-dione
CID 63109398
8-bromo-3,6-dimethyl-1H-quinoxalin-2-one
CID 90421767
7-bromo-3-iodo-2,8-dimethyl-1H-quinolin-4-one
CID 121237111
6-bromo-7-methyl-1H-indole
CID 24729281
6-bromo-2,3,7-trimethyl-1H-indole
CID 130050197

Frequently Asked Questions

What is the IUPAC name of 7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one?
The IUPAC name of 7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one (CID 162524476) is 7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one.
What is the SMILES notation for 7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one?
The canonical SMILES for 7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one is COc1nc2ccc(Br)c(C)c2[nH]c1=O.
What is the InChIKey of 7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one?
The InChIKey is HHPOTFYOMCZQGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrN2O2/c1-5-6(11)3-4-7-8(5)13-9(14)10(12-7)15-2/h3-4H,1-2H3,(H,13,14).
What are the key properties of 7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one?
7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one has a molecular weight of 269.10 g/mol, XLogP of 2.00, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-3-methoxy-8-methyl-1H-quinoxalin-2-one is sourced from PubChem (CID 162524476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).