5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide

C14H15ClN2O4S — CID 56826904

IUPAC5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide
SMILESCCC(NC(=O)c1ccc(Cl)o1)c1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C14H15ClN2O4S/c1-2-11(17-14(18)12-6-7-13(15)21-12)9-4-3-5-10(8-9)22(16,19)20/h3-8,11H,2H2,1H3,(H,17,18)(H2,16,19,20)
InChIKeyZRJXDAHHPWTHIW-UHFFFAOYSA-N
MW342.80 g/mol
LogP2.46
Rot. Bonds5

About 5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide

5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide (PubChem CID 56826904) has the molecular formula C14H15ClN2O4S and a molecular weight of 342.80 g/mol. Its IUPAC name is 5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide
PubChem CID56826904
Molecular FormulaC14H15ClN2O4S
Molecular Weight342.80 g/mol
Exact Mass342.04
IUPAC Name5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide
SMILESCCC(NC(=O)c1ccc(Cl)o1)c1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C14H15ClN2O4S/c1-2-11(17-14(18)12-6-7-13(15)21-12)9-4-3-5-10(8-9)22(16,19)20/h3-8,11H,2H2,1H3,(H,17,18)(H2,16,19,20)
InChIKeyZRJXDAHHPWTHIW-UHFFFAOYSA-N
XLogP2.46
TPSA102.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.80
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-2-(4-chlorophenyl)-N-[1-(3-sulfamoylphenyl)propyl]propanamide
CID 166383331
2-(4-fluorophenyl)-2-hydroxy-N-[1-(3-sulfamoylphenyl)propyl]acetamide
CID 166223102
N-[1-(3-chlorophenyl)propyl]-5-piperidin-1-ylsulfonylfuran-2-carboxamide
CID 55632155
N-[1-(3-sulfamoylphenyl)propyl]bicyclo[4.2.0]octa-1,3,5-triene-7-carboxamide
CID 122145623
3-methyl-N-[1-(3-sulfamoylphenyl)ethyl]pentanamide
CID 114876353
4-bromo-N-[1-(3-chlorophenyl)propyl]-3-fluorobenzamide
CID 63526336
1,1-diethyl-3-[1-(3-sulfamoylphenyl)ethyl]urea
CID 112729478
N-[1-(3-sulfamoylphenyl)ethyl]benzo[e][1]benzofuran-2-carboxamide
CID 167857934
3,5-dichloro-N-[1-(3-sulfamoylphenyl)ethyl]benzamide
CID 51213469
3-[(1R)-1-(1,3-benzoxazol-2-ylamino)propyl]benzenesulfonamide
CID 95329361
N-[1-(3-sulfamoylphenyl)ethyl]-5-[3-(trifluoromethyl)phenyl]furan-2-carboxamide
CID 55396044
1-[(2S)-4-(4-bromophenyl)butan-2-yl]-3-[(1R)-1-(3-sulfamoylphenyl)ethyl]urea
CID 52510601

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide?
The IUPAC name of 5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide (CID 56826904) is 5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide?
The canonical SMILES for 5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide is CCC(NC(=O)c1ccc(Cl)o1)c1cccc(S(N)(=O)=O)c1.
What is the InChIKey of 5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide?
The InChIKey is ZRJXDAHHPWTHIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O4S/c1-2-11(17-14(18)12-6-7-13(15)21-12)9-4-3-5-10(8-9)22(16,19)20/h3-8,11H,2H2,1H3,(H,17,18)(H2,16,19,20).
What are the key properties of 5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide?
5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide has a molecular weight of 342.80 g/mol, XLogP of 2.46, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[1-(3-sulfamoylphenyl)propyl]furan-2-carboxamide is sourced from PubChem (CID 56826904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).