N-pentylthiophene-2-sulfonamide

C9H15NO2S2 — CID 5150701

IUPACN-pentylthiophene-2-sulfonamide
SMILESCCCCCNS(=O)(=O)c1cccs1
InChIInChI=1S/C9H15NO2S2/c1-2-3-4-7-10-14(11,12)9-6-5-8-13-9/h5-6,8,10H,2-4,7H2,1H3
InChIKeyMEJXQDJNMXTVJI-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.22
Rot. Bonds6

About N-pentylthiophene-2-sulfonamide

N-pentylthiophene-2-sulfonamide (PubChem CID 5150701) has the molecular formula C9H15NO2S2 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-pentylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-pentylthiophene-2-sulfonamide
PubChem CID5150701
Molecular FormulaC9H15NO2S2
Molecular Weight233.36 g/mol
Exact Mass233.05
IUPAC NameN-pentylthiophene-2-sulfonamide
SMILESCCCCCNS(=O)(=O)c1cccs1
InChIInChI=1S/C9H15NO2S2/c1-2-3-4-7-10-14(11,12)9-6-5-8-13-9/h5-6,8,10H,2-4,7H2,1H3
InChIKeyMEJXQDJNMXTVJI-UHFFFAOYSA-N
XLogP2.22
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-dodecylthiophene-2-sulfonamide
CID 19681497
dimethyl-[3-(thiophen-2-ylsulfonylamino)propyl]azanium
CID 7765655
methyl 6-(thiophen-2-ylsulfonylamino)hexanoate
CID 43404961
N-(3-aminopropyl)thiophene-2-sulfonamide;hydrochloride
CID 119962042
N-[2-(thiophen-2-ylsulfonylamino)ethyl]pentanamide
CID 108573837
N-(4-cyanobutyl)thiophene-2-sulfonamide
CID 63297087
N-(4-phenylbutyl)thiophene-2-sulfonamide
CID 3802488
N-[2-(methylamino)ethyl]thiophene-2-sulfonamide
CID 62658549
N-[2-(ethylamino)ethyl]thiophene-2-sulfonamide;hydrochloride
CID 119973565
N-(2-ethoxyethyl)thiophene-2-sulfonamide
CID 3855268
N-(3-phenoxypropyl)thiophene-2-sulfonamide
CID 47122008
N-[3-(4-methoxyphenyl)propyl]thiophene-2-sulfonamide
CID 47330584

Frequently Asked Questions

What is the IUPAC name of N-pentylthiophene-2-sulfonamide?
The IUPAC name of N-pentylthiophene-2-sulfonamide (CID 5150701) is N-pentylthiophene-2-sulfonamide.
What is the SMILES notation for N-pentylthiophene-2-sulfonamide?
The canonical SMILES for N-pentylthiophene-2-sulfonamide is CCCCCNS(=O)(=O)c1cccs1.
What is the InChIKey of N-pentylthiophene-2-sulfonamide?
The InChIKey is MEJXQDJNMXTVJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2S2/c1-2-3-4-7-10-14(11,12)9-6-5-8-13-9/h5-6,8,10H,2-4,7H2,1H3.
What are the key properties of N-pentylthiophene-2-sulfonamide?
N-pentylthiophene-2-sulfonamide has a molecular weight of 233.36 g/mol, XLogP of 2.22, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentylthiophene-2-sulfonamide is sourced from PubChem (CID 5150701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).