4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine

C20H19FN2OS — CID 2741194

IUPAC4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine
SMILESCc1sc(N2CCOCC2)nc1-c1ccc(-c2ccccc2F)cc1
InChIInChI=1S/C20H19FN2OS/c1-14-19(22-20(25-14)23-10-12-24-13-11-23)16-8-6-15(7-9-16)17-4-2-3-5-18(17)21/h2-9H,10-13H2,1H3
InChIKeyKFPCHYAPVKBHPQ-UHFFFAOYSA-N
MW354.45 g/mol
LogP4.76
Rot. Bonds3

About 4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine

4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine (PubChem CID 2741194) has the molecular formula C20H19FN2OS and a molecular weight of 354.45 g/mol. Its IUPAC name is 4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine.

Molecular Properties

Compound Name4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine
PubChem CID2741194
Molecular FormulaC20H19FN2OS
Molecular Weight354.45 g/mol
Exact Mass354.12
IUPAC Name4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine
SMILESCc1sc(N2CCOCC2)nc1-c1ccc(-c2ccccc2F)cc1
InChIInChI=1S/C20H19FN2OS/c1-14-19(22-20(25-14)23-10-12-24-13-11-23)16-8-6-15(7-9-16)17-4-2-3-5-18(17)21/h2-9H,10-13H2,1H3
InChIKeyKFPCHYAPVKBHPQ-UHFFFAOYSA-N
XLogP4.76
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine?
The IUPAC name of 4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine (CID 2741194) is 4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine.
What is the SMILES notation for 4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine?
The canonical SMILES for 4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine is Cc1sc(N2CCOCC2)nc1-c1ccc(-c2ccccc2F)cc1.
What is the InChIKey of 4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine?
The InChIKey is KFPCHYAPVKBHPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN2OS/c1-14-19(22-20(25-14)23-10-12-24-13-11-23)16-8-6-15(7-9-16)17-4-2-3-5-18(17)21/h2-9H,10-13H2,1H3.
What are the key properties of 4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine?
4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine has a molecular weight of 354.45 g/mol, XLogP of 4.76, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[4-(2-fluorophenyl)phenyl]-5-methyl-1,3-thiazol-2-yl]morpholine is sourced from PubChem (CID 2741194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).