N-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide

C17H22N2O3S2 — CID 38356025

IUPACN-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide
SMILESCCCNS(=O)(=O)c1ccc(NC(=O)CCCc2cccs2)cc1
InChIInChI=1S/C17H22N2O3S2/c1-2-12-18-24(21,22)16-10-8-14(9-11-16)19-17(20)7-3-5-15-6-4-13-23-15/h4,6,8-11,13,18H,2-3,5,7,12H2,1H3,(H,19,20)
InChIKeyAGMQDTKIUKONCO-UHFFFAOYSA-N
MW366.51 g/mol
LogP3.40
Rot. Bonds9

About N-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide

N-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide (PubChem CID 38356025) has the molecular formula C17H22N2O3S2 and a molecular weight of 366.51 g/mol. Its IUPAC name is N-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide.

Molecular Properties

Compound NameN-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide
PubChem CID38356025
Molecular FormulaC17H22N2O3S2
Molecular Weight366.51 g/mol
Exact Mass366.11
IUPAC NameN-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide
SMILESCCCNS(=O)(=O)c1ccc(NC(=O)CCCc2cccs2)cc1
InChIInChI=1S/C17H22N2O3S2/c1-2-12-18-24(21,22)16-10-8-14(9-11-16)19-17(20)7-3-5-15-6-4-13-23-15/h4,6,8-11,13,18H,2-3,5,7,12H2,1H3,(H,19,20)
InChIKeyAGMQDTKIUKONCO-UHFFFAOYSA-N
XLogP3.40
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(propylsulfamoyl)phenyl]pentanamide
CID 17321429
N-[4-(3-methoxypropylsulfamoyl)phenyl]-2-thiophen-2-ylacetamide
CID 3160786
7-amino-N-[4-(propylsulfamoyl)phenyl]heptanamide;hydrochloride
CID 119720435
N-[4-(2-methylpropanoylamino)phenyl]-4-thiophen-2-ylbutanamide
CID 26907103
3-[(4-chlorophenyl)sulfonylamino]-N-[4-(propylsulfamoyl)phenyl]propanamide
CID 17225792
N-[4-(2-phenylethylsulfamoyl)phenyl]heptanamide
CID 54790596
4-propyl-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 3793246
N-[[4-(propylsulfamoyl)phenyl]carbamothioyl]pentanamide
CID 4932989
N-(4-ethylphenyl)-3-thiophen-2-ylpropanamide
CID 70852355
N-hexyl-4-(2-thiophen-2-ylethylsulfamoyl)benzamide
CID 30854127
N-[4-(ethylsulfamoyl)phenyl]butanamide
CID 2992581
N-[4-(2-methoxyphenoxy)phenyl]-4-thiophen-2-ylbutanamide
CID 27901791

Frequently Asked Questions

What is the IUPAC name of N-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide?
The IUPAC name of N-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide (CID 38356025) is N-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide.
What is the SMILES notation for N-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide?
The canonical SMILES for N-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide is CCCNS(=O)(=O)c1ccc(NC(=O)CCCc2cccs2)cc1.
What is the InChIKey of N-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide?
The InChIKey is AGMQDTKIUKONCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O3S2/c1-2-12-18-24(21,22)16-10-8-14(9-11-16)19-17(20)7-3-5-15-6-4-13-23-15/h4,6,8-11,13,18H,2-3,5,7,12H2,1H3,(H,19,20).
What are the key properties of N-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide?
N-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide has a molecular weight of 366.51 g/mol, XLogP of 3.40, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(propylsulfamoyl)phenyl]-4-thiophen-2-ylbutanamide is sourced from PubChem (CID 38356025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).