4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine

C11H11F3N4S — CID 166604633

IUPAC4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine
SMILESFC(F)(F)c1cn2ccnc(N3CCSCC3)c2n1
InChIInChI=1S/C11H11F3N4S/c12-11(13,14)8-7-18-2-1-15-9(10(18)16-8)17-3-5-19-6-4-17/h1-2,7H,3-6H2
InChIKeyHOMWJFJXZJWWLK-UHFFFAOYSA-N
MW288.30 g/mol
LogP2.30
Rot. Bonds1

About 4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine

4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine (PubChem CID 166604633) has the molecular formula C11H11F3N4S and a molecular weight of 288.30 g/mol. Its IUPAC name is 4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine.

Molecular Properties

Compound Name4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine
PubChem CID166604633
Molecular FormulaC11H11F3N4S
Molecular Weight288.30 g/mol
Exact Mass288.07
IUPAC Name4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine
SMILESFC(F)(F)c1cn2ccnc(N3CCSCC3)c2n1
InChIInChI=1S/C11H11F3N4S/c12-11(13,14)8-7-18-2-1-15-9(10(18)16-8)17-3-5-19-6-4-17/h1-2,7H,3-6H2
InChIKeyHOMWJFJXZJWWLK-UHFFFAOYSA-N
XLogP2.30
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.30
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine?
The IUPAC name of 4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine (CID 166604633) is 4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine.
What is the SMILES notation for 4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine?
The canonical SMILES for 4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine is FC(F)(F)c1cn2ccnc(N3CCSCC3)c2n1.
What is the InChIKey of 4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine?
The InChIKey is HOMWJFJXZJWWLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3N4S/c12-11(13,14)8-7-18-2-1-15-9(10(18)16-8)17-3-5-19-6-4-17/h1-2,7H,3-6H2.
What are the key properties of 4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine?
4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine has a molecular weight of 288.30 g/mol, XLogP of 2.30, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-yl]thiomorpholine is sourced from PubChem (CID 166604633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).