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

C16H17FN2O4S — CID 17192102

IUPAC3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(NC(=O)CCNS(=O)(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C16H17FN2O4S/c1-23-14-6-4-13(5-7-14)19-16(20)10-11-18-24(21,22)15-8-2-12(17)3-9-15/h2-9,18H,10-11H2,1H3,(H,19,20)
InChIKeyIDCPROIXFUYOEP-UHFFFAOYSA-N
MW352.39 g/mol
LogP2.14
Rot. Bonds7

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

3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide (PubChem CID 17192102) has the molecular formula C16H17FN2O4S and a molecular weight of 352.39 g/mol. Its IUPAC name is 3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide.

Molecular Properties

Compound Name3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
PubChem CID17192102
Molecular FormulaC16H17FN2O4S
Molecular Weight352.39 g/mol
Exact Mass352.09
IUPAC Name3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(NC(=O)CCNS(=O)(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C16H17FN2O4S/c1-23-14-6-4-13(5-7-14)19-16(20)10-11-18-24(21,22)15-8-2-12(17)3-9-15/h2-9,18H,10-11H2,1H3,(H,19,20)
InChIKeyIDCPROIXFUYOEP-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

4-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)butanamide
CID 9411896
N-(4-acetamidophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 17192669
N-(3-fluorophenyl)-3-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 17192589
3-[(4-fluorophenyl)sulfonylamino]-N-(4-methylphenyl)propanamide
CID 9452229
3-[(4-methoxyphenyl)sulfonylamino]-N-pyridin-4-ylpropanamide
CID 17192611
3-[(3,4-dimethylphenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
CID 9412008
3-[(4-fluorophenyl)sulfonylamino]-N-[4-(methanesulfonamido)phenyl]propanamide
CID 25373946
3-[(4-fluorophenyl)sulfonylamino]-N-[4-(hexylsulfamoyl)phenyl]propanamide
CID 17192252
4-[3-[(4-fluorophenyl)sulfonylamino]propanoylamino]benzamide
CID 9441750
N-(4-ethoxyphenyl)-4-[(4-fluorophenyl)sulfonylamino]butanamide
CID 9410697
3-[(4-fluorophenyl)sulfonylamino]-N-[4-(methanesulfonamido)-3-methoxyphenyl]propanamide
CID 55635947
3-[(4-methoxyphenyl)sulfonylamino]-N-(4-methyl-3-sulfamoylphenyl)propanamide
CID 24637727

Frequently Asked Questions

What is the IUPAC name of 3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide?
The IUPAC name of 3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide (CID 17192102) is 3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide.
What is the SMILES notation for 3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide?
The canonical SMILES for 3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide is COc1ccc(NC(=O)CCNS(=O)(=O)c2ccc(F)cc2)cc1.
What is the InChIKey of 3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide?
The InChIKey is IDCPROIXFUYOEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O4S/c1-23-14-6-4-13(5-7-14)19-16(20)10-11-18-24(21,22)15-8-2-12(17)3-9-15/h2-9,18H,10-11H2,1H3,(H,19,20).
What are the key properties of 3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide?
3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)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 3-[(4-fluorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide is sourced from PubChem (CID 17192102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).