5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide

C14H25NO2S2 — CID 60530858

IUPAC5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)N(CC(C)C)CC(C)C)s1
InChIInChI=1S/C14H25NO2S2/c1-6-13-7-8-14(18-13)19(16,17)15(9-11(2)3)10-12(4)5/h7-8,11-12H,6,9-10H2,1-5H3
InChIKeyUKWSAQYPINWOLD-UHFFFAOYSA-N
MW303.49 g/mol
LogP3.61
Rot. Bonds7

About 5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide

5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide (PubChem CID 60530858) has the molecular formula C14H25NO2S2 and a molecular weight of 303.49 g/mol. Its IUPAC name is 5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide
PubChem CID60530858
Molecular FormulaC14H25NO2S2
Molecular Weight303.49 g/mol
Exact Mass303.13
IUPAC Name5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)N(CC(C)C)CC(C)C)s1
InChIInChI=1S/C14H25NO2S2/c1-6-13-7-8-14(18-13)19(16,17)15(9-11(2)3)10-12(4)5/h7-8,11-12H,6,9-10H2,1-5H3
InChIKeyUKWSAQYPINWOLD-UHFFFAOYSA-N
XLogP3.61
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.49
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-ethylthiophene-2-sulfonyl bromide
CID 119092797
2-[(5-ethylthiophen-2-yl)sulfonyl-methylamino]propanoic acid
CID 62637176
5-ethyl-N-(3-hydroxypropyl)-N-propan-2-ylthiophene-2-sulfonamide
CID 54947843
2-[(5-ethylthiophen-2-yl)sulfonyl-propylamino]-N'-hydroxyethanimidamide
CID 76927493
5-ethyl-N-propan-2-ylthiophene-2-sulfonamide
CID 61059652
5-bromo-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)thiophene-2-sulfonamide
CID 54937883
2-[(5-ethylthiophen-2-yl)sulfonyl-methylamino]-N'-hydroxypropanimidamide
CID 76928228
5-ethyl-N-(2-hydroxy-3-methoxypropyl)-N-methylthiophene-2-sulfonamide
CID 54999328
N-(2-bromoethyl)-5-ethyl-N-pentan-3-ylthiophene-2-sulfonamide
CID 80675259
4-ethyl-N,N-bis(2-methylpropyl)benzenesulfonamide
CID 19682262
N-(4-aminophenyl)-N,5-diethylthiophene-2-sulfonamide
CID 63234172
5-ethyl-N-(5-hydroxypentyl)-N-methylthiophene-2-sulfonamide
CID 107202942

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide?
The IUPAC name of 5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide (CID 60530858) is 5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)N(CC(C)C)CC(C)C)s1.
What is the InChIKey of 5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide?
The InChIKey is UKWSAQYPINWOLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2S2/c1-6-13-7-8-14(18-13)19(16,17)15(9-11(2)3)10-12(4)5/h7-8,11-12H,6,9-10H2,1-5H3.
What are the key properties of 5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide?
5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide has a molecular weight of 303.49 g/mol, XLogP of 3.61, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N,N-bis(2-methylpropyl)thiophene-2-sulfonamide is sourced from PubChem (CID 60530858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).