2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide

C20H17FN2O3S — CID 75416503

IUPAC2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide
SMILESCC(C(=O)Nc1ccc(-c2ccccc2)cn1)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C20H17FN2O3S/c1-14(27(25,26)18-10-8-17(21)9-11-18)20(24)23-19-12-7-16(13-22-19)15-5-3-2-4-6-15/h2-14H,1H3,(H,22,23,24)
InChIKeyTWFIZOWFHZTTRE-UHFFFAOYSA-N
MW384.43 g/mol
LogP3.69
Rot. Bonds5

About 2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide

2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide (PubChem CID 75416503) has the molecular formula C20H17FN2O3S and a molecular weight of 384.43 g/mol. Its IUPAC name is 2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide
PubChem CID75416503
Molecular FormulaC20H17FN2O3S
Molecular Weight384.43 g/mol
Exact Mass384.09
IUPAC Name2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide
SMILESCC(C(=O)Nc1ccc(-c2ccccc2)cn1)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C20H17FN2O3S/c1-14(27(25,26)18-10-8-17(21)9-11-18)20(24)23-19-12-7-16(13-22-19)15-5-3-2-4-6-15/h2-14H,1H3,(H,22,23,24)
InChIKeyTWFIZOWFHZTTRE-UHFFFAOYSA-N
XLogP3.69
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.43
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide?
The IUPAC name of 2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide (CID 75416503) is 2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide.
What is the SMILES notation for 2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide?
The canonical SMILES for 2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide is CC(C(=O)Nc1ccc(-c2ccccc2)cn1)S(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide?
The InChIKey is TWFIZOWFHZTTRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2O3S/c1-14(27(25,26)18-10-8-17(21)9-11-18)20(24)23-19-12-7-16(13-22-19)15-5-3-2-4-6-15/h2-14H,1H3,(H,22,23,24).
What are the key properties of 2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide?
2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide has a molecular weight of 384.43 g/mol, XLogP of 3.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)sulfonyl-N-(5-phenyl-2-pyridinyl)propanamide is sourced from PubChem (CID 75416503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).