4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide

C12H12F2N2O3S2 — CID 138021169

IUPAC4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide
SMILESCCOc1cccc(NS(=O)(=O)c2cscc2C(F)F)n1
InChIInChI=1S/C12H12F2N2O3S2/c1-2-19-11-5-3-4-10(15-11)16-21(17,18)9-7-20-6-8(9)12(13)14/h3-7,12H,2H2,1H3,(H,15,16)
InChIKeyBTNBYDPKVFNWKQ-UHFFFAOYSA-N
MW334.37 g/mol
LogP3.28
Rot. Bonds6

About 4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide

4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide (PubChem CID 138021169) has the molecular formula C12H12F2N2O3S2 and a molecular weight of 334.37 g/mol. Its IUPAC name is 4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide.

Molecular Properties

Compound Name4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide
PubChem CID138021169
Molecular FormulaC12H12F2N2O3S2
Molecular Weight334.37 g/mol
Exact Mass334.03
IUPAC Name4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide
SMILESCCOc1cccc(NS(=O)(=O)c2cscc2C(F)F)n1
InChIInChI=1S/C12H12F2N2O3S2/c1-2-19-11-5-3-4-10(15-11)16-21(17,18)9-7-20-6-8(9)12(13)14/h3-7,12H,2H2,1H3,(H,15,16)
InChIKeyBTNBYDPKVFNWKQ-UHFFFAOYSA-N
XLogP3.28
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.37
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[6-(2,2-difluoroethoxy)-2-pyridinyl]ethanesulfonamide
CID 75510360
6-(Thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine
CID 102719937
N-methyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine
CID 102719938
N-ethyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine
CID 102719939
N-propyl-6-(thiophen-2-ylmethoxy)-4-(trifluoromethyl)pyridin-2-amine
CID 102719940
6-(2-Thiophen-2-ylethoxy)-4-(trifluoromethyl)pyridin-2-amine
CID 102719943
N-methyl-6-(2-thiophen-2-ylethoxy)-4-(trifluoromethyl)pyridin-2-amine
CID 102719944
N-ethyl-6-(2-thiophen-2-ylethoxy)-4-(trifluoromethyl)pyridin-2-amine
CID 102719945
[6-(2-Thiophen-2-ylethoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 102721297
3,5-Difluoro-6-(thiophen-2-ylmethoxy)pyridin-2-amine
CID 108367169
[6-(Thiophen-2-ylmethoxy)-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 113728567
3,5-Difluoro-6-(2-thiophen-2-ylethoxy)pyridin-2-amine
CID 114073381

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide?
The IUPAC name of 4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide (CID 138021169) is 4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide.
What is the SMILES notation for 4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide?
The canonical SMILES for 4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide is CCOc1cccc(NS(=O)(=O)c2cscc2C(F)F)n1.
What is the InChIKey of 4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide?
The InChIKey is BTNBYDPKVFNWKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F2N2O3S2/c1-2-19-11-5-3-4-10(15-11)16-21(17,18)9-7-20-6-8(9)12(13)14/h3-7,12H,2H2,1H3,(H,15,16).
What are the key properties of 4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide?
4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide has a molecular weight of 334.37 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-N-(6-ethoxy-2-pyridinyl)thiophene-3-sulfonamide is sourced from PubChem (CID 138021169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).