2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine

C13H16N4S — CID 133309139

IUPAC2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine
SMILESCC1SCCN(c2ccc3nccnc3n2)C1C
InChIInChI=1S/C13H16N4S/c1-9-10(2)18-8-7-17(9)12-4-3-11-13(16-12)15-6-5-14-11/h3-6,9-10H,7-8H2,1-2H3
InChIKeyCAJUYOGZFLDYAT-UHFFFAOYSA-N
MW260.37 g/mol
LogP2.36
Rot. Bonds1

About 2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine

2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine (PubChem CID 133309139) has the molecular formula C13H16N4S and a molecular weight of 260.37 g/mol. Its IUPAC name is 2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine.

Molecular Properties

Compound Name2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine
PubChem CID133309139
Molecular FormulaC13H16N4S
Molecular Weight260.37 g/mol
Exact Mass260.11
IUPAC Name2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine
SMILESCC1SCCN(c2ccc3nccnc3n2)C1C
InChIInChI=1S/C13H16N4S/c1-9-10(2)18-8-7-17(9)12-4-3-11-13(16-12)15-6-5-14-11/h3-6,9-10H,7-8H2,1-2H3
InChIKeyCAJUYOGZFLDYAT-UHFFFAOYSA-N
XLogP2.36
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.37
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine
CID 75368987
6-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)pyrido[2,3-b]pyrazine
CID 133343862
1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol
CID 126835844
6-(3-methyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrido[2,3-b]pyrazine
CID 133463810
6-(3-chloro-4-methylpiperidin-1-yl)pyrido[2,3-b]pyrazine
CID 102960882
6-[3-(4-methylpiperazin-1-yl)azetidin-1-yl]pyrido[2,3-b]pyrazine
CID 126891851
2,2-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine
CID 75377317
6-[4-methyl-2-(5-methylfuran-2-yl)piperidin-1-yl]pyrido[2,3-b]pyrazine
CID 133332575
3-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid
CID 107070403
4-methyl-1-pyrido[2,3-b]pyrazin-6-ylpiperidine-2-carboxylic acid
CID 114422197
4-(3-bromo-4-methyl-2-pyridinyl)-2,3-dimethylthiomorpholine
CID 106877510
6-[4-(2-methoxyethyl)-3-methylpiperazin-1-yl]pyrido[2,3-b]pyrazine
CID 133301736

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine?
The IUPAC name of 2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine (CID 133309139) is 2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine.
What is the SMILES notation for 2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine?
The canonical SMILES for 2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine is CC1SCCN(c2ccc3nccnc3n2)C1C.
What is the InChIKey of 2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine?
The InChIKey is CAJUYOGZFLDYAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4S/c1-9-10(2)18-8-7-17(9)12-4-3-11-13(16-12)15-6-5-14-11/h3-6,9-10H,7-8H2,1-2H3.
What are the key properties of 2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine?
2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine has a molecular weight of 260.37 g/mol, XLogP of 2.36, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-4-pyrido[2,3-b]pyrazin-6-ylthiomorpholine is sourced from PubChem (CID 133309139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).