3-methyl-4-pyrazin-2-ylthiomorpholine

C9H13N3S — CID 131155886

IUPAC3-methyl-4-pyrazin-2-ylthiomorpholine
SMILESCC1CSCCN1c1cnccn1
InChIInChI=1S/C9H13N3S/c1-8-7-13-5-4-12(8)9-6-10-2-3-11-9/h2-3,6,8H,4-5,7H2,1H3
InChIKeyRYHUDNJJJXLKBG-UHFFFAOYSA-N
MW195.29 g/mol
LogP1.42
Rot. Bonds1

About 3-methyl-4-pyrazin-2-ylthiomorpholine

3-methyl-4-pyrazin-2-ylthiomorpholine (PubChem CID 131155886) has the molecular formula C9H13N3S and a molecular weight of 195.29 g/mol. Its IUPAC name is 3-methyl-4-pyrazin-2-ylthiomorpholine.

Molecular Properties

Compound Name3-methyl-4-pyrazin-2-ylthiomorpholine
PubChem CID131155886
Molecular FormulaC9H13N3S
Molecular Weight195.29 g/mol
Exact Mass195.08
IUPAC Name3-methyl-4-pyrazin-2-ylthiomorpholine
SMILESCC1CSCCN1c1cnccn1
InChIInChI=1S/C9H13N3S/c1-8-7-13-5-4-12(8)9-6-10-2-3-11-9/h2-3,6,8H,4-5,7H2,1H3
InChIKeyRYHUDNJJJXLKBG-UHFFFAOYSA-N
XLogP1.42
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.29
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3-methylthiomorpholin-4-yl)pyrazin-2-amine
CID 80652917
N-methyl-1-[6-(3-methylthiomorpholin-4-yl)pyrazin-2-yl]methanamine
CID 66450723
4-pyrazin-2-ylthiomorpholine
CID 131156249
N-[[3-(3-methylthiomorpholin-4-yl)-4-pyridinyl]methyl]cyclopropanamine
CID 105073996
N-[[5-chloro-2-(3-methylthiomorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine
CID 114926559
4-[5-(chloromethyl)-4-methylpyrimidin-2-yl]-3-methylthiomorpholine
CID 83184152
2-(5-chloro-2-methylpiperidin-1-yl)pyrazine
CID 130855779
N-[[5-chloro-2-(3-methylthiomorpholin-4-yl)-4-pyridinyl]methyl]-2-methylpropan-1-amine
CID 114926562
4-(6-chloropyrazin-2-yl)-3-methylsulfonylthiomorpholine
CID 66383089
2-methyl-6-(3-methylthiomorpholin-4-yl)pyridine-4-carbonitrile
CID 114766322
1-[5-fluoro-2-(3-methylthiomorpholin-4-yl)-3-pyridinyl]-N-methylmethanamine
CID 114035380
N-ethyl-2-methyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine
CID 80836054

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-pyrazin-2-ylthiomorpholine?
The IUPAC name of 3-methyl-4-pyrazin-2-ylthiomorpholine (CID 131155886) is 3-methyl-4-pyrazin-2-ylthiomorpholine.
What is the SMILES notation for 3-methyl-4-pyrazin-2-ylthiomorpholine?
The canonical SMILES for 3-methyl-4-pyrazin-2-ylthiomorpholine is CC1CSCCN1c1cnccn1.
What is the InChIKey of 3-methyl-4-pyrazin-2-ylthiomorpholine?
The InChIKey is RYHUDNJJJXLKBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3S/c1-8-7-13-5-4-12(8)9-6-10-2-3-11-9/h2-3,6,8H,4-5,7H2,1H3.
What are the key properties of 3-methyl-4-pyrazin-2-ylthiomorpholine?
3-methyl-4-pyrazin-2-ylthiomorpholine has a molecular weight of 195.29 g/mol, XLogP of 1.42, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-pyrazin-2-ylthiomorpholine is sourced from PubChem (CID 131155886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).