2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide

C14H14Cl2N2O3S — CID 6463724

IUPAC2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide
SMILESCCOc1cc(Cl)c(S(=O)(=O)Nc2cccc(C)n2)cc1Cl
InChIInChI=1S/C14H14Cl2N2O3S/c1-3-21-12-7-11(16)13(8-10(12)15)22(19,20)18-14-6-4-5-9(2)17-14/h4-8H,3H2,1-2H3,(H,17,18)
InChIKeyOZDPCFILHCZLBD-UHFFFAOYSA-N
MW361.25 g/mol
LogP3.90
Rot. Bonds5

About 2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide

2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide (PubChem CID 6463724) has the molecular formula C14H14Cl2N2O3S and a molecular weight of 361.25 g/mol. Its IUPAC name is 2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide
PubChem CID6463724
Molecular FormulaC14H14Cl2N2O3S
Molecular Weight361.25 g/mol
Exact Mass360.01
IUPAC Name2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide
SMILESCCOc1cc(Cl)c(S(=O)(=O)Nc2cccc(C)n2)cc1Cl
InChIInChI=1S/C14H14Cl2N2O3S/c1-3-21-12-7-11(16)13(8-10(12)15)22(19,20)18-14-6-4-5-9(2)17-14/h4-8H,3H2,1-2H3,(H,17,18)
InChIKeyOZDPCFILHCZLBD-UHFFFAOYSA-N
XLogP3.90
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.25
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,4-dichloro-5-methyl-N-(6-methyl-2-pyridinyl)benzenesulfonamide
CID 16644970
4-bromo-3-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide
CID 47071432
4,5-dimethyl-N-(6-methyl-2-pyridinyl)-2-propoxybenzenesulfonamide
CID 16644972
2,5-dimethoxy-4-methyl-N-(6-methyl-2-pyridinyl)benzenesulfonamide
CID 6463553
2,5-dichloro-N-(6-ethyl-2-pyridinyl)benzenesulfonamide
CID 3868272
2-(methylamino)-N-(6-methyl-2-pyridinyl)benzenesulfonamide
CID 55044313
5-chloro-4-ethoxy-2-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide
CID 110757998
5-(aminomethyl)-2-methyl-N-(6-methyl-2-pyridinyl)thiophene-3-sulfonamide
CID 106086961
5-(aminomethyl)-2-methyl-N-(6-methyl-2-pyridinyl)furan-3-sulfonamide
CID 106086878
3-(ethylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide
CID 103303472
4-ethoxy-2-methyl-5-propan-2-yl-N-pyridin-2-ylbenzenesulfonamide
CID 2986731
5-bromo-N-(2-chloropyrimidin-4-yl)-2-ethoxybenzenesulfonamide
CID 116798881

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide?
The IUPAC name of 2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide (CID 6463724) is 2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide?
The canonical SMILES for 2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide is CCOc1cc(Cl)c(S(=O)(=O)Nc2cccc(C)n2)cc1Cl.
What is the InChIKey of 2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide?
The InChIKey is OZDPCFILHCZLBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2N2O3S/c1-3-21-12-7-11(16)13(8-10(12)15)22(19,20)18-14-6-4-5-9(2)17-14/h4-8H,3H2,1-2H3,(H,17,18).
What are the key properties of 2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide?
2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide has a molecular weight of 361.25 g/mol, XLogP of 3.90, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-4-ethoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 6463724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).