4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine

C11H21N3OS — CID 155003910

IUPAC4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine
SMILESCC(C)C1C=NC(OCC2CSCN2)CN1
InChIInChI=1S/C11H21N3OS/c1-8(2)10-3-13-11(4-12-10)15-5-9-6-16-7-14-9/h3,8-12,14H,4-7H2,1-2H3
InChIKeyWEFYZHVCSKUUDJ-UHFFFAOYSA-N
MW243.38 g/mol
LogP0.69
Rot. Bonds4

About 4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine

4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine (PubChem CID 155003910) has the molecular formula C11H21N3OS and a molecular weight of 243.38 g/mol. Its IUPAC name is 4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine.

Molecular Properties

Compound Name4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine
PubChem CID155003910
Molecular FormulaC11H21N3OS
Molecular Weight243.38 g/mol
Exact Mass243.14
IUPAC Name4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine
SMILESCC(C)C1C=NC(OCC2CSCN2)CN1
InChIInChI=1S/C11H21N3OS/c1-8(2)10-3-13-11(4-12-10)15-5-9-6-16-7-14-9/h3,8-12,14H,4-7H2,1-2H3
InChIKeyWEFYZHVCSKUUDJ-UHFFFAOYSA-N
XLogP0.69
TPSA45.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.38
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine?
The IUPAC name of 4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine (CID 155003910) is 4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine.
What is the SMILES notation for 4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine?
The canonical SMILES for 4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine is CC(C)C1C=NC(OCC2CSCN2)CN1.
What is the InChIKey of 4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine?
The InChIKey is WEFYZHVCSKUUDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3OS/c1-8(2)10-3-13-11(4-12-10)15-5-9-6-16-7-14-9/h3,8-12,14H,4-7H2,1-2H3.
What are the key properties of 4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine?
4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine has a molecular weight of 243.38 g/mol, XLogP of 0.69, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-propan-2-yl-1,2,3,6-tetrahydropyrazin-3-yl)oxymethyl]-1,3-thiazolidine is sourced from PubChem (CID 155003910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).