7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine

C8H10BrN3 — CID 84691711

IUPAC7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine
SMILESCN1CCNc2ncc(Br)cc21
InChIInChI=1S/C8H10BrN3/c1-12-3-2-10-8-7(12)4-6(9)5-11-8/h4-5H,2-3H2,1H3,(H,10,11)
InChIKeyZKTUOAOQCBTIMC-UHFFFAOYSA-N
MW228.09 g/mol
LogP1.71
Rot. Bonds

About 7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine

7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine (PubChem CID 84691711) has the molecular formula C8H10BrN3 and a molecular weight of 228.09 g/mol. Its IUPAC name is 7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine
PubChem CID84691711
Molecular FormulaC8H10BrN3
Molecular Weight228.09 g/mol
Exact Mass227.01
IUPAC Name7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine
SMILESCN1CCNc2ncc(Br)cc21
InChIInChI=1S/C8H10BrN3/c1-12-3-2-10-8-7(12)4-6(9)5-11-8/h4-5H,2-3H2,1H3,(H,10,11)
InChIKeyZKTUOAOQCBTIMC-UHFFFAOYSA-N
XLogP1.71
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.09
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 22139127
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CID 83839922
5-bromo-3-piperazin-1-ylpyridine-2-carbonitrile
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4-methyl-2,3-dihydro-1H-pyrido[2,3-b]pyrazin-7-amine
CID 118184538
(3S)-6-bromo-3-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine
CID 51893478
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5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine
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2-(5-bromo-2-chloro-3-pyridinyl)-1,2,6-thiadiazinane
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Frequently Asked Questions

What is the IUPAC name of 7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine?
The IUPAC name of 7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine (CID 84691711) is 7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine.
What is the SMILES notation for 7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine?
The canonical SMILES for 7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine is CN1CCNc2ncc(Br)cc21.
What is the InChIKey of 7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine?
The InChIKey is ZKTUOAOQCBTIMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10BrN3/c1-12-3-2-10-8-7(12)4-6(9)5-11-8/h4-5H,2-3H2,1H3,(H,10,11).
What are the key properties of 7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine?
7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine has a molecular weight of 228.09 g/mol, XLogP of 1.71, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-1-methyl-3,4-dihydro-2H-pyrido[2,3-b]pyrazine is sourced from PubChem (CID 84691711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).