3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide

C14H19N3O2S2 — CID 103305547

IUPAC3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide
SMILESCCNc1cccnc1S(=O)(=O)NC(C)c1ccc(C)s1
InChIInChI=1S/C14H19N3O2S2/c1-4-15-12-6-5-9-16-14(12)21(18,19)17-11(3)13-8-7-10(2)20-13/h5-9,11,15,17H,4H2,1-3H3
InChIKeyRGRRCRUNCJRMHR-UHFFFAOYSA-N
MW325.46 g/mol
LogP2.92
Rot. Bonds6

About 3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide

3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide (PubChem CID 103305547) has the molecular formula C14H19N3O2S2 and a molecular weight of 325.46 g/mol. Its IUPAC name is 3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide
PubChem CID103305547
Molecular FormulaC14H19N3O2S2
Molecular Weight325.46 g/mol
Exact Mass325.09
IUPAC Name3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide
SMILESCCNc1cccnc1S(=O)(=O)NC(C)c1ccc(C)s1
InChIInChI=1S/C14H19N3O2S2/c1-4-15-12-6-5-9-16-14(12)21(18,19)17-11(3)13-8-7-10(2)20-13/h5-9,11,15,17H,4H2,1-3H3
InChIKeyRGRRCRUNCJRMHR-UHFFFAOYSA-N
XLogP2.92
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.46
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide
CID 62153288
3-(ethylamino)-N-(1-thiophen-3-ylethyl)pyridine-2-sulfonamide
CID 103305812
3-(ethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-2-sulfonamide
CID 103304947
2-cyano-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-3-sulfonamide
CID 106545698
3-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-sulfonamide
CID 107642917
3-(methylamino)-N-(1-thiophen-2-ylethyl)pyridine-2-sulfonamide
CID 103304572
N-cyclopropyl-3-(ethylamino)pyridine-2-sulfonamide
CID 103303691
N-(4-methylpentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103304534
2-(ethylaminomethyl)-N-[1-(5-methylthiophen-2-yl)ethyl]thiophene-3-sulfonamide
CID 106050317
N-(2-bromophenyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103303927
3-(ethylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide
CID 103303472
3-(ethylamino)-N-(1-ethylcyclobutyl)pyridine-2-sulfonamide
CID 103307452

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide?
The IUPAC name of 3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide (CID 103305547) is 3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide.
What is the SMILES notation for 3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide?
The canonical SMILES for 3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide is CCNc1cccnc1S(=O)(=O)NC(C)c1ccc(C)s1.
What is the InChIKey of 3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide?
The InChIKey is RGRRCRUNCJRMHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2S2/c1-4-15-12-6-5-9-16-14(12)21(18,19)17-11(3)13-8-7-10(2)20-13/h5-9,11,15,17H,4H2,1-3H3.
What are the key properties of 3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide?
3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide has a molecular weight of 325.46 g/mol, XLogP of 2.92, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide is sourced from PubChem (CID 103305547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).