4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine

C9H12N4OS — CID 15357586

IUPAC4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine
SMILESCc1cn2nc(N3CCOCC3)sc2n1
InChIInChI=1S/C9H12N4OS/c1-7-6-13-8(10-7)15-9(11-13)12-2-4-14-5-3-12/h6H,2-5H2,1H3
InChIKeyZTXHLVWTOYWPAJ-UHFFFAOYSA-N
MW224.29 g/mol
LogP0.94
Rot. Bonds1

About 4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine

4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine (PubChem CID 15357586) has the molecular formula C9H12N4OS and a molecular weight of 224.29 g/mol. Its IUPAC name is 4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine.

Molecular Properties

Compound Name4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine
PubChem CID15357586
Molecular FormulaC9H12N4OS
Molecular Weight224.29 g/mol
Exact Mass224.07
IUPAC Name4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine
SMILESCc1cn2nc(N3CCOCC3)sc2n1
InChIInChI=1S/C9H12N4OS/c1-7-6-13-8(10-7)15-9(11-13)12-2-4-14-5-3-12/h6H,2-5H2,1H3
InChIKeyZTXHLVWTOYWPAJ-UHFFFAOYSA-N
XLogP0.94
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.29
LogP ≤ 50.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine?
The IUPAC name of 4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine (CID 15357586) is 4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine.
What is the SMILES notation for 4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine?
The canonical SMILES for 4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine is Cc1cn2nc(N3CCOCC3)sc2n1.
What is the InChIKey of 4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine?
The InChIKey is ZTXHLVWTOYWPAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4OS/c1-7-6-13-8(10-7)15-9(11-13)12-2-4-14-5-3-12/h6H,2-5H2,1H3.
What are the key properties of 4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine?
4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine has a molecular weight of 224.29 g/mol, XLogP of 0.94, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)morpholine is sourced from PubChem (CID 15357586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).