3-Methyl-4-pyrazin-2-ylthiomorpholine

Name: 3-Methyl-4-pyrazin-2-ylthiomorpholine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₉H₁₃N₃S — CID 131155886

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

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 Name	3-Methyl-4-pyrazin-2-ylthiomorpholine
PubChem CID	131155886
Molecular Formula	C₉H₁₃N₃S
Molecular Weight	195.29 g/mol
Exact Mass	195.08
IUPAC Name	3-methyl-4-pyrazin-2-ylthiomorpholine
SMILES	CC1CSCCN1c1cnccn1
InChI	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
InChIKey	RYHUDNJJJXLKBG-UHFFFAOYSA-N
XLogP	1.42
TPSA	29.02 Å²
H-Bond Donors
H-Bond Acceptors	4
Rotatable Bonds	1
Heavy Atoms	13
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	195.29
LogP ≤ 5	1.42
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

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).

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Sources

PubChem CID 131155886 — identifiers, structure, computed properties (public domain)

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