5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide

C13H23NO3S2 — CID 103835206

IUPAC5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NCC(O)C(CC)CC)s1
InChIInChI=1S/C13H23NO3S2/c1-4-10(5-2)12(15)9-14-19(16,17)13-8-7-11(6-3)18-13/h7-8,10,12,14-15H,4-6,9H2,1-3H3
InChIKeyHCWYVSSWSJLFCY-UHFFFAOYSA-N
MW305.47 g/mol
LogP2.39
Rot. Bonds8

About 5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide

5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide (PubChem CID 103835206) has the molecular formula C13H23NO3S2 and a molecular weight of 305.47 g/mol. Its IUPAC name is 5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide
PubChem CID103835206
Molecular FormulaC13H23NO3S2
Molecular Weight305.47 g/mol
Exact Mass305.11
IUPAC Name5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)NCC(O)C(CC)CC)s1
InChIInChI=1S/C13H23NO3S2/c1-4-10(5-2)12(15)9-14-19(16,17)13-8-7-11(6-3)18-13/h7-8,10,12,14-15H,4-6,9H2,1-3H3
InChIKeyHCWYVSSWSJLFCY-UHFFFAOYSA-N
XLogP2.39
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.47
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-N-(2-ethylbutyl)thiophene-2-sulfonamide
CID 115613311
5-ethyl-N-(2-hydroxy-3-phenylpropyl)thiophene-2-sulfonamide
CID 90534466
5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide
CID 64994375
5-chloro-N-(3-ethyl-2-hydroxypentyl)-4-methylthiophene-2-sulfonamide
CID 103270087
N-(2-chloro-2-cyclopropylethyl)-5-ethylthiophene-2-sulfonamide
CID 65031848
5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide
CID 114616513
N-(2-amino-2-methylpropyl)-5-ethylthiophene-2-sulfonamide
CID 115303410
N-(cyanomethyl)-5-ethylthiophene-2-sulfonamide
CID 61454174
5-ethyl-N-[4-(1-hydroxyethyl)phenyl]thiophene-2-sulfonamide
CID 61454703
5-ethyl-N-propan-2-ylthiophene-2-sulfonamide
CID 61059652
N-(3-ethyl-2-hydroxypentyl)-1H-pyrrole-3-sulfonamide
CID 106288400
N-(3-bromopropyl)-5-ethylthiophene-2-sulfonamide
CID 61454391

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide?
The IUPAC name of 5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide (CID 103835206) is 5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)NCC(O)C(CC)CC)s1.
What is the InChIKey of 5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide?
The InChIKey is HCWYVSSWSJLFCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO3S2/c1-4-10(5-2)12(15)9-14-19(16,17)13-8-7-11(6-3)18-13/h7-8,10,12,14-15H,4-6,9H2,1-3H3.
What are the key properties of 5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide?
5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide has a molecular weight of 305.47 g/mol, XLogP of 2.39, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(3-ethyl-2-hydroxypentyl)thiophene-2-sulfonamide is sourced from PubChem (CID 103835206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).