2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide

C19H21FN2O5S — CID 3153549

IUPAC2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide
SMILESCC(Oc1ccc(F)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C19H21FN2O5S/c1-14(27-17-6-2-15(20)3-7-17)19(23)21-16-4-8-18(9-5-16)28(24,25)22-10-12-26-13-11-22/h2-9,14H,10-13H2,1H3,(H,21,23)
InChIKeySGIOLADIGOZYNQ-UHFFFAOYSA-N
MW408.45 g/mol
LogP2.25
Rot. Bonds6

About 2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide

2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide (PubChem CID 3153549) has the molecular formula C19H21FN2O5S and a molecular weight of 408.45 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide.

Molecular Properties

Compound Name2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide
PubChem CID3153549
Molecular FormulaC19H21FN2O5S
Molecular Weight408.45 g/mol
Exact Mass408.12
IUPAC Name2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide
SMILESCC(Oc1ccc(F)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C19H21FN2O5S/c1-14(27-17-6-2-15(20)3-7-17)19(23)21-16-4-8-18(9-5-16)28(24,25)22-10-12-26-13-11-22/h2-9,14H,10-13H2,1H3,(H,21,23)
InChIKeySGIOLADIGOZYNQ-UHFFFAOYSA-N
XLogP2.25
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.45
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide?
The IUPAC name of 2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide (CID 3153549) is 2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide.
What is the SMILES notation for 2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide?
The canonical SMILES for 2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide is CC(Oc1ccc(F)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1.
What is the InChIKey of 2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide?
The InChIKey is SGIOLADIGOZYNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O5S/c1-14(27-17-6-2-15(20)3-7-17)19(23)21-16-4-8-18(9-5-16)28(24,25)22-10-12-26-13-11-22/h2-9,14H,10-13H2,1H3,(H,21,23).
What are the key properties of 2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide?
2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide has a molecular weight of 408.45 g/mol, XLogP of 2.25, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide is sourced from PubChem (CID 3153549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).