[2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone

C20H24FN3O5S — CID 71837485

IUPAC[2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone
SMILESCc1oc(C2CCN(S(=O)(=O)c3ccccc3F)CC2)nc1C(=O)N1CCOCC1
InChIInChI=1S/C20H24FN3O5S/c1-14-18(20(25)23-10-12-28-13-11-23)22-19(29-14)15-6-8-24(9-7-15)30(26,27)17-5-3-2-4-16(17)21/h2-5,15H,6-13H2,1H3
InChIKeyMTCAXTBIIAJYIY-UHFFFAOYSA-N
MW437.49 g/mol
LogP2.16
Rot. Bonds4

About [2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone

[2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone (PubChem CID 71837485) has the molecular formula C20H24FN3O5S and a molecular weight of 437.49 g/mol. Its IUPAC name is [2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone
PubChem CID71837485
Molecular FormulaC20H24FN3O5S
Molecular Weight437.49 g/mol
Exact Mass437.14
IUPAC Name[2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone
SMILESCc1oc(C2CCN(S(=O)(=O)c3ccccc3F)CC2)nc1C(=O)N1CCOCC1
InChIInChI=1S/C20H24FN3O5S/c1-14-18(20(25)23-10-12-28-13-11-23)22-19(29-14)15-6-8-24(9-7-15)30(26,27)17-5-3-2-4-16(17)21/h2-5,15H,6-13H2,1H3
InChIKeyMTCAXTBIIAJYIY-UHFFFAOYSA-N
XLogP2.16
TPSA92.95 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.49
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze [2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone (CID 71837485) is [2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone is Cc1oc(C2CCN(S(=O)(=O)c3ccccc3F)CC2)nc1C(=O)N1CCOCC1.
What is the InChIKey of [2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone?
The InChIKey is MTCAXTBIIAJYIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FN3O5S/c1-14-18(20(25)23-10-12-28-13-11-23)22-19(29-14)15-6-8-24(9-7-15)30(26,27)17-5-3-2-4-16(17)21/h2-5,15H,6-13H2,1H3.
What are the key properties of [2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone?
[2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone has a molecular weight of 437.49 g/mol, XLogP of 2.16, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[1-(2-fluorophenyl)sulfonylpiperidin-4-yl]-5-methyl-1,3-oxazol-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 71837485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).