N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide

C11H11ClN2O2S2 — CID 113231899

IUPACN-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(Cl)nc2)s1
InChIInChI=1S/C11H11ClN2O2S2/c1-2-9-4-6-11(17-9)18(15,16)14-8-3-5-10(12)13-7-8/h3-7,14H,2H2,1H3
InChIKeyIZEUEARDTSTIOE-UHFFFAOYSA-N
MW302.81 g/mol
LogP3.16
Rot. Bonds4

About N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide

N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide (PubChem CID 113231899) has the molecular formula C11H11ClN2O2S2 and a molecular weight of 302.81 g/mol. Its IUPAC name is N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide
PubChem CID113231899
Molecular FormulaC11H11ClN2O2S2
Molecular Weight302.81 g/mol
Exact Mass302.00
IUPAC NameN-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(Cl)nc2)s1
InChIInChI=1S/C11H11ClN2O2S2/c1-2-9-4-6-11(17-9)18(15,16)14-8-3-5-10(12)13-7-8/h3-7,14H,2H2,1H3
InChIKeyIZEUEARDTSTIOE-UHFFFAOYSA-N
XLogP3.16
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.81
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

5-ethyl-N-(4-iodophenyl)thiophene-2-sulfonamide
CID 47309223
N-(3,5-dichlorophenyl)-5-ethylthiophene-2-sulfonamide
CID 113098917
5-ethyl-N-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]thiophene-2-sulfonamide
CID 113011834
N-(3-amino-4-chlorophenyl)-5-ethylthiophene-2-sulfonamide
CID 61454417
5-ethyl-N-(4-methoxyphenyl)thiophene-2-sulfonamide
CID 47309103
N-(3,4-dimethylphenyl)-5-ethylthiophene-2-sulfonamide
CID 47308966
5-ethyl-N-pyrimidin-2-ylthiophene-2-sulfonamide
CID 75517993
N-[6-(2,3-dimethylanilino)-3-pyridinyl]-5-ethylthiophene-2-sulfonamide
CID 113017331
N-(2-chloro-5-methyl-3-pyridinyl)-5-ethylthiophene-2-sulfonamide
CID 102976090
5-(ethylaminomethyl)-N-(6-methyl-3-pyridinyl)thiophene-2-sulfonamide
CID 106073184
N-(4-cyanophenyl)-5-ethylthiophene-2-sulfonamide
CID 47309319
5-ethyl-N-imidazo[1,2-a]pyridin-6-ylthiophene-2-sulfonamide
CID 110734784

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide?
The IUPAC name of N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide (CID 113231899) is N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide.
What is the SMILES notation for N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide?
The canonical SMILES for N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide is CCc1ccc(S(=O)(=O)Nc2ccc(Cl)nc2)s1.
What is the InChIKey of N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide?
The InChIKey is IZEUEARDTSTIOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN2O2S2/c1-2-9-4-6-11(17-9)18(15,16)14-8-3-5-10(12)13-7-8/h3-7,14H,2H2,1H3.
What are the key properties of N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide?
N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide has a molecular weight of 302.81 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-3-pyridinyl)-5-ethylthiophene-2-sulfonamide is sourced from PubChem (CID 113231899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).