6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine

C14H10BrN3O — CID 81333354

IUPAC6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine
SMILESCc1cc(Oc2ccc3nccnc3n2)ccc1Br
InChIInChI=1S/C14H10BrN3O/c1-9-8-10(2-3-11(9)15)19-13-5-4-12-14(18-13)17-7-6-16-12/h2-8H,1H3
InChIKeyYWFOVDZMMSSKFG-UHFFFAOYSA-N
MW316.16 g/mol
LogP3.89
Rot. Bonds2

About 6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine

6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine (PubChem CID 81333354) has the molecular formula C14H10BrN3O and a molecular weight of 316.16 g/mol. Its IUPAC name is 6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine
PubChem CID81333354
Molecular FormulaC14H10BrN3O
Molecular Weight316.16 g/mol
Exact Mass315.00
IUPAC Name6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine
SMILESCc1cc(Oc2ccc3nccnc3n2)ccc1Br
InChIInChI=1S/C14H10BrN3O/c1-9-8-10(2-3-11(9)15)19-13-5-4-12-14(18-13)17-7-6-16-12/h2-8H,1H3
InChIKeyYWFOVDZMMSSKFG-UHFFFAOYSA-N
XLogP3.89
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.16
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-(4-iodophenoxy)pyrido[2,3-b]pyrazine
CID 78955285
3-bromo-5-pyrido[2,3-b]pyrazin-6-yloxyaniline
CID 103589174
2-(4-bromo-3-methylphenoxy)-5-methylpyridine
CID 83141020
2-(4-bromo-3-methylphenoxy)-5-chloropyridine
CID 83132873
[6-(4-bromo-3-methylphenoxy)-2-methyl-3-pyridinyl]methanamine
CID 83135138
4-(4-bromo-3-methylphenoxy)-6-methylpyrimidine
CID 81334328
5-(4-bromo-3-methylphenoxy)pyrazolo[1,5-a]pyrimidine
CID 83132957
6-(4-bromo-3-methylphenoxy)-2-propan-2-yloxypyridin-3-amine
CID 83133166
4-(4-bromo-3-methylphenoxy)-6-methylpyrimidin-2-amine
CID 83135228
6-(2-iodo-5-methylphenoxy)pyrido[2,3-b]pyrazine
CID 133355817
2-(4-bromo-3-methylphenoxy)-4-(trifluoromethyl)pyridine
CID 83133978
2-(4-bromo-3-methylphenoxy)pyridine-4-carbonitrile
CID 83132770

Frequently Asked Questions

What is the IUPAC name of 6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine?
The IUPAC name of 6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine (CID 81333354) is 6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine.
What is the SMILES notation for 6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine?
The canonical SMILES for 6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine is Cc1cc(Oc2ccc3nccnc3n2)ccc1Br.
What is the InChIKey of 6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine?
The InChIKey is YWFOVDZMMSSKFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrN3O/c1-9-8-10(2-3-11(9)15)19-13-5-4-12-14(18-13)17-7-6-16-12/h2-8H,1H3.
What are the key properties of 6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine?
6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine has a molecular weight of 316.16 g/mol, XLogP of 3.89, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-bromo-3-methylphenoxy)pyrido[2,3-b]pyrazine is sourced from PubChem (CID 81333354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).