2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide

C14H19N3O2S2 — CID 62153288

IUPAC2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)NC(C)c2ccc(C)s2)ccn1
InChIInChI=1S/C14H19N3O2S2/c1-4-15-14-9-12(7-8-16-14)21(18,19)17-11(3)13-6-5-10(2)20-13/h5-9,11,17H,4H2,1-3H3,(H,15,16)
InChIKeyXHALAMOUWFUDTJ-UHFFFAOYSA-N
MW325.46 g/mol
LogP2.92
Rot. Bonds6

About 2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide

2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide (PubChem CID 62153288) has the molecular formula C14H19N3O2S2 and a molecular weight of 325.46 g/mol. Its IUPAC name is 2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide
PubChem CID62153288
Molecular FormulaC14H19N3O2S2
Molecular Weight325.46 g/mol
Exact Mass325.09
IUPAC Name2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)NC(C)c2ccc(C)s2)ccn1
InChIInChI=1S/C14H19N3O2S2/c1-4-15-14-9-12(7-8-16-14)21(18,19)17-11(3)13-6-5-10(2)20-13/h5-9,11,17H,4H2,1-3H3,(H,15,16)
InChIKeyXHALAMOUWFUDTJ-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-propan-2-ylpyridine-4-sulfonamide
CID 62149834
3-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide
CID 103305547
2-(ethylamino)-N-(3-ethylpentan-2-yl)pyridine-4-sulfonamide
CID 63838256
2-(ethylamino)-N-(1-pyridin-2-ylethyl)pyridine-4-sulfonamide
CID 62146235
N-(1-ethoxypropan-2-yl)-2-(ethylamino)pyridine-4-sulfonamide
CID 62158252
2-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-4-sulfonamide
CID 64605539
N-(1-cyclopropylpropan-2-yl)-2-(ethylamino)pyridine-4-sulfonamide
CID 63996785
2-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-4-sulfonamide
CID 102907920
5,6-dichloro-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-3-sulfonamide
CID 64607266
2-(ethylamino)-N-(3-ethylpentan-3-yl)pyridine-4-sulfonamide
CID 65042331
N-[1-(5-methylthiophen-2-yl)ethyl]-2,3-dihydro-1H-indole-5-sulfonamide
CID 61477904
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-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide?
The IUPAC name of 2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide (CID 62153288) is 2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide.
What is the SMILES notation for 2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide?
The canonical SMILES for 2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide is CCNc1cc(S(=O)(=O)NC(C)c2ccc(C)s2)ccn1.
What is the InChIKey of 2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide?
The InChIKey is XHALAMOUWFUDTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2S2/c1-4-15-14-9-12(7-8-16-14)21(18,19)17-11(3)13-6-5-10(2)20-13/h5-9,11,17H,4H2,1-3H3,(H,15,16).
What are the key properties of 2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide?
2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-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 2-(ethylamino)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-4-sulfonamide is sourced from PubChem (CID 62153288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).