2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide

C13H17N3O2S2 — CID 62145050

IUPAC2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)NCCc2cccs2)ccn1
InChIInChI=1S/C13H17N3O2S2/c1-2-14-13-10-12(6-7-15-13)20(17,18)16-8-5-11-4-3-9-19-11/h3-4,6-7,9-10,16H,2,5,8H2,1H3,(H,14,15)
InChIKeyVUQQMPVEMOHFLU-UHFFFAOYSA-N
MW311.43 g/mol
LogP2.10
Rot. Bonds7

About 2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide

2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide (PubChem CID 62145050) has the molecular formula C13H17N3O2S2 and a molecular weight of 311.43 g/mol. Its IUPAC name is 2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide
PubChem CID62145050
Molecular FormulaC13H17N3O2S2
Molecular Weight311.43 g/mol
Exact Mass311.08
IUPAC Name2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)NCCc2cccs2)ccn1
InChIInChI=1S/C13H17N3O2S2/c1-2-14-13-10-12(6-7-15-13)20(17,18)16-8-5-11-4-3-9-19-11/h3-4,6-7,9-10,16H,2,5,8H2,1H3,(H,14,15)
InChIKeyVUQQMPVEMOHFLU-UHFFFAOYSA-N
XLogP2.10
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(methylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide
CID 62145049
6-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-3-sulfonamide
CID 62144358
2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyrimidine-5-sulfonamide
CID 62144877
2-(ethylamino)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-4-sulfonamide
CID 64523776
4-propyl-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 3793246
2-(ethylamino)-N-[2-(1-methylpyrazol-3-yl)ethyl]pyridine-4-sulfonamide
CID 106106320
2-(ethylamino)-N-(4,4,4-trifluorobutyl)pyridine-4-sulfonamide
CID 115522007
3-bromo-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 3793268
2-(ethylamino)-N-(3-ethylpentan-3-yl)pyridine-4-sulfonamide
CID 65042331
N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-(propylamino)pyridine-4-sulfonamide
CID 106407859
2-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-4-sulfonamide
CID 102907920
2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide
CID 62162458

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide?
The IUPAC name of 2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide (CID 62145050) is 2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide.
What is the SMILES notation for 2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide?
The canonical SMILES for 2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide is CCNc1cc(S(=O)(=O)NCCc2cccs2)ccn1.
What is the InChIKey of 2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide?
The InChIKey is VUQQMPVEMOHFLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2S2/c1-2-14-13-10-12(6-7-15-13)20(17,18)16-8-5-11-4-3-9-19-11/h3-4,6-7,9-10,16H,2,5,8H2,1H3,(H,14,15).
What are the key properties of 2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide?
2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide has a molecular weight of 311.43 g/mol, XLogP of 2.10, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide is sourced from PubChem (CID 62145050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).