3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide

C16H17FN2O4S — CID 9428553

IUPAC3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide
SMILESCOc1ccc(NC(=O)CCc2ccccc2F)cc1S(N)(=O)=O
InChIInChI=1S/C16H17FN2O4S/c1-23-14-8-7-12(10-15(14)24(18,21)22)19-16(20)9-6-11-4-2-3-5-13(11)17/h2-5,7-8,10H,6,9H2,1H3,(H,19,20)(H2,18,21,22)
InChIKeyCWNTUOHIXOUMRL-UHFFFAOYSA-N
MW352.39 g/mol
LogP2.05
Rot. Bonds6

About 3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide

3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide (PubChem CID 9428553) has the molecular formula C16H17FN2O4S and a molecular weight of 352.39 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide.

Molecular Properties

Compound Name3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide
PubChem CID9428553
Molecular FormulaC16H17FN2O4S
Molecular Weight352.39 g/mol
Exact Mass352.09
IUPAC Name3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide
SMILESCOc1ccc(NC(=O)CCc2ccccc2F)cc1S(N)(=O)=O
InChIInChI=1S/C16H17FN2O4S/c1-23-14-8-7-12(10-15(14)24(18,21)22)19-16(20)9-6-11-4-2-3-5-13(11)17/h2-5,7-8,10H,6,9H2,1H3,(H,19,20)(H2,18,21,22)
InChIKeyCWNTUOHIXOUMRL-UHFFFAOYSA-N
XLogP2.05
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-(4-methoxy-3-sulfamoylphenyl)butanamide
CID 47245842
4-(4-chlorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)butanamide
CID 55788529
2-(2-tert-butylphenoxy)-N-(4-methoxy-3-sulfamoylphenyl)acetamide
CID 26782054
3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)but-2-enamide
CID 76869379
3-(2-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]-4-methoxyphenyl]propanamide
CID 29436777
3-(2,3-dimethoxyphenyl)-N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]propanamide
CID 9020974
3-(2,6-difluorophenyl)-N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methoxyphenyl]propanamide
CID 55651750
3-(2-hydroxyphenyl)-N-[4-methoxy-3-(4-methoxyphenoxy)phenyl]propanamide
CID 25432728
N-(4-methoxy-3-sulfamoylphenyl)-2,2-dimethylpropanamide
CID 43082414
N-[3-[(4-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-3-(1H-indol-3-yl)propanamide
CID 3938486
(3R)-3-acetamido-N-(4-methoxy-3-sulfamoylphenyl)-3-phenylpropanamide
CID 7999988
3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide
CID 24583642

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide?
The IUPAC name of 3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide (CID 9428553) is 3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide.
What is the SMILES notation for 3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide?
The canonical SMILES for 3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide is COc1ccc(NC(=O)CCc2ccccc2F)cc1S(N)(=O)=O.
What is the InChIKey of 3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide?
The InChIKey is CWNTUOHIXOUMRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O4S/c1-23-14-8-7-12(10-15(14)24(18,21)22)19-16(20)9-6-11-4-2-3-5-13(11)17/h2-5,7-8,10H,6,9H2,1H3,(H,19,20)(H2,18,21,22).
What are the key properties of 3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide?
3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide has a molecular weight of 352.39 g/mol, XLogP of 2.05, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-N-(4-methoxy-3-sulfamoylphenyl)propanamide is sourced from PubChem (CID 9428553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).