N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide

C13H15NO3S2 — CID 5002728

IUPACN-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide
SMILESCC(C)Oc1ccc(NS(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C13H15NO3S2/c1-10(2)17-12-7-5-11(6-8-12)14-19(15,16)13-4-3-9-18-13/h3-10,14H,1-2H3
InChIKeyFWMMNSQNMBZXOQ-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.34
Rot. Bonds5

About N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide

N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide (PubChem CID 5002728) has the molecular formula C13H15NO3S2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide
PubChem CID5002728
Molecular FormulaC13H15NO3S2
Molecular Weight297.40 g/mol
Exact Mass297.05
IUPAC NameN-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide
SMILESCC(C)Oc1ccc(NS(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C13H15NO3S2/c1-10(2)17-12-7-5-11(6-8-12)14-19(15,16)13-4-3-9-18-13/h3-10,14H,1-2H3
InChIKeyFWMMNSQNMBZXOQ-UHFFFAOYSA-N
XLogP3.34
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(4-propan-2-yloxyanilino)-3-pyridinyl]thiophene-2-sulfonamide
CID 113019944
N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]thiophene-2-sulfonamide
CID 1092869
N-(3-fluoro-4-propan-2-yloxyphenyl)thiophene-2-sulfonamide
CID 110777493
N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide
CID 43416696
5-methyl-N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide
CID 47310549
N-[4-(4-ethoxyanilino)phenyl]thiophene-2-sulfonamide
CID 112987709
N-(4-prop-2-enoxyphenyl)thiophene-2-sulfonamide
CID 6493654
N-[4-(N-methylanilino)phenyl]thiophene-2-sulfonamide
CID 112986152
N-[4-[1-(ethylamino)ethyl]phenyl]thiophene-2-sulfonamide
CID 43508090
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]thiophene-2-sulfonamide
CID 42998818
N-[4-[(4-methylphenyl)sulfamoyl]phenyl]thiophene-2-sulfonamide
CID 1075762
N-[4-[2-(dimethylamino)ethylamino]phenyl]thiophene-2-sulfonamide
CID 112981383

Frequently Asked Questions

What is the IUPAC name of N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide?
The IUPAC name of N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide (CID 5002728) is N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide?
The canonical SMILES for N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide is CC(C)Oc1ccc(NS(=O)(=O)c2cccs2)cc1.
What is the InChIKey of N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide?
The InChIKey is FWMMNSQNMBZXOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO3S2/c1-10(2)17-12-7-5-11(6-8-12)14-19(15,16)13-4-3-9-18-13/h3-10,14H,1-2H3.
What are the key properties of N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide?
N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide has a molecular weight of 297.40 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 5002728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).