4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine

C15H17FN2OS — CID 2973604

IUPAC4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine
SMILESCC1CN(c2nc(-c3ccc(F)cc3)cs2)CC(C)O1
InChIInChI=1S/C15H17FN2OS/c1-10-7-18(8-11(2)19-10)15-17-14(9-20-15)12-3-5-13(16)6-4-12/h3-6,9-11H,7-8H2,1-2H3
InChIKeyMUROXLDNBJXKAX-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.56
Rot. Bonds2

About 4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine

4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine (PubChem CID 2973604) has the molecular formula C15H17FN2OS and a molecular weight of 292.38 g/mol. Its IUPAC name is 4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine.

Molecular Properties

Compound Name4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine
PubChem CID2973604
Molecular FormulaC15H17FN2OS
Molecular Weight292.38 g/mol
Exact Mass292.10
IUPAC Name4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine
SMILESCC1CN(c2nc(-c3ccc(F)cc3)cs2)CC(C)O1
InChIInChI=1S/C15H17FN2OS/c1-10-7-18(8-11(2)19-10)15-17-14(9-20-15)12-3-5-13(16)6-4-12/h3-6,9-11H,7-8H2,1-2H3
InChIKeyMUROXLDNBJXKAX-UHFFFAOYSA-N
XLogP3.56
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine?
The IUPAC name of 4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine (CID 2973604) is 4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine.
What is the SMILES notation for 4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine?
The canonical SMILES for 4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine is CC1CN(c2nc(-c3ccc(F)cc3)cs2)CC(C)O1.
What is the InChIKey of 4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine?
The InChIKey is MUROXLDNBJXKAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2OS/c1-10-7-18(8-11(2)19-10)15-17-14(9-20-15)12-3-5-13(16)6-4-12/h3-6,9-11H,7-8H2,1-2H3.
What are the key properties of 4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine?
4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine has a molecular weight of 292.38 g/mol, XLogP of 3.56, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-2,6-dimethylmorpholine is sourced from PubChem (CID 2973604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).