N-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride

C11H13ClN2O2S2 — CID 6602955

IUPACN-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride
SMILESCl.O=S(=O)(NCCc1ccccn1)c1cccs1
InChIInChI=1S/C11H12N2O2S2.ClH/c14-17(15,11-5-3-9-16-11)13-8-6-10-4-1-2-7-12-10;/h1-5,7,9,13H,6,8H2;1H
InChIKeyBSWFLBGVRIXSOY-UHFFFAOYSA-N
MW304.82 g/mol
LogP2.09
Rot. Bonds5

About N-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride

N-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride (PubChem CID 6602955) has the molecular formula C11H13ClN2O2S2 and a molecular weight of 304.82 g/mol. Its IUPAC name is N-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride
PubChem CID6602955
Molecular FormulaC11H13ClN2O2S2
Molecular Weight304.82 g/mol
Exact Mass304.01
IUPAC NameN-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride
SMILESCl.O=S(=O)(NCCc1ccccn1)c1cccs1
InChIInChI=1S/C11H12N2O2S2.ClH/c14-17(15,11-5-3-9-16-11)13-8-6-10-4-1-2-7-12-10;/h1-5,7,9,13H,6,8H2;1H
InChIKeyBSWFLBGVRIXSOY-UHFFFAOYSA-N
XLogP2.09
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.82
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride?
The IUPAC name of N-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride (CID 6602955) is N-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride.
What is the SMILES notation for N-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride?
The canonical SMILES for N-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride is Cl.O=S(=O)(NCCc1ccccn1)c1cccs1.
What is the InChIKey of N-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride?
The InChIKey is BSWFLBGVRIXSOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2S2.ClH/c14-17(15,11-5-3-9-16-11)13-8-6-10-4-1-2-7-12-10;/h1-5,7,9,13H,6,8H2;1H.
What are the key properties of N-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride?
N-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride has a molecular weight of 304.82 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyridin-2-ylethyl)thiophene-2-sulfonamide;hydrochloride is sourced from PubChem (CID 6602955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).