N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide

C16H17FN2O4S — CID 17192589

IUPACN-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide
SMILESCOc1ccc(S(=O)(=O)NCCC(=O)Nc2cccc(F)c2)cc1
InChIInChI=1S/C16H17FN2O4S/c1-23-14-5-7-15(8-6-14)24(21,22)18-10-9-16(20)19-13-4-2-3-12(17)11-13/h2-8,11,18H,9-10H2,1H3,(H,19,20)
InChIKeyOWNNWGCYKZPSGG-UHFFFAOYSA-N
MW352.39 g/mol
LogP2.14
Rot. Bonds7

About N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide

N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide (PubChem CID 17192589) has the molecular formula C16H17FN2O4S and a molecular weight of 352.39 g/mol. Its IUPAC name is N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide
PubChem CID17192589
Molecular FormulaC16H17FN2O4S
Molecular Weight352.39 g/mol
Exact Mass352.09
IUPAC NameN-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide
SMILESCOc1ccc(S(=O)(=O)NCCC(=O)Nc2cccc(F)c2)cc1
InChIInChI=1S/C16H17FN2O4S/c1-23-14-5-7-15(8-6-14)24(21,22)18-10-9-16(20)19-13-4-2-3-12(17)11-13/h2-8,11,18H,9-10H2,1H3,(H,19,20)
InChIKeyOWNNWGCYKZPSGG-UHFFFAOYSA-N
XLogP2.14
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-fluorophenyl)-3-[(4-fluorophenyl)sulfonylamino]propanamide
CID 17192108
3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
CID 17192102
3-[(4-methoxyphenyl)sulfonylamino]-N-[3-(trifluoromethyl)phenyl]propanamide
CID 17192578
3-(benzenesulfonamido)-N-(3-fluorophenyl)propanamide
CID 9412312
3-[(4-bromophenyl)sulfonylamino]-N-(3-fluorophenyl)propanamide
CID 2576569
3-[(4-bromophenyl)sulfonylamino]-N-(3-methoxyphenyl)propanamide
CID 17192407
3-[(4-methoxyphenyl)sulfonylamino]-N-pyridin-4-ylpropanamide
CID 17192611
N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 17192669
3-(3-fluoroanilino)-N-(4-methoxyphenyl)propanamide
CID 109039637
3-[(3-bromophenyl)sulfonylamino]-N-(3-fluorophenyl)propanamide
CID 9412446
4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide
CID 9411896
3-[(4-methoxyphenyl)sulfonylamino]-N-(4-methyl-3-sulfamoylphenyl)propanamide
CID 24637727

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide?
The IUPAC name of N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide (CID 17192589) is N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide.
What is the SMILES notation for N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide?
The canonical SMILES for N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide is COc1ccc(S(=O)(=O)NCCC(=O)Nc2cccc(F)c2)cc1.
What is the InChIKey of N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide?
The InChIKey is OWNNWGCYKZPSGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O4S/c1-23-14-5-7-15(8-6-14)24(21,22)18-10-9-16(20)19-13-4-2-3-12(17)11-13/h2-8,11,18H,9-10H2,1H3,(H,19,20).
What are the key properties of N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide?
N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide has a molecular weight of 352.39 g/mol, XLogP of 2.14, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide is sourced from PubChem (CID 17192589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).