2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide

C13H12Cl2N2O3S — CID 82913767

IUPAC2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(OCCc2cccnc2)c(Cl)c1Cl
InChIInChI=1S/C13H12Cl2N2O3S/c14-12-10(3-4-11(13(12)15)21(16,18)19)20-7-5-9-2-1-6-17-8-9/h1-4,6,8H,5,7H2,(H2,16,18,19)
InChIKeySUTUGJFKYLBVJE-UHFFFAOYSA-N
MW347.22 g/mol
LogP2.66
Rot. Bonds5

About 2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide

2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide (PubChem CID 82913767) has the molecular formula C13H12Cl2N2O3S and a molecular weight of 347.22 g/mol. Its IUPAC name is 2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide.

Molecular Properties

Compound Name2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide
PubChem CID82913767
Molecular FormulaC13H12Cl2N2O3S
Molecular Weight347.22 g/mol
Exact Mass345.99
IUPAC Name2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(OCCc2cccnc2)c(Cl)c1Cl
InChIInChI=1S/C13H12Cl2N2O3S/c14-12-10(3-4-11(13(12)15)21(16,18)19)20-7-5-9-2-1-6-17-8-9/h1-4,6,8H,5,7H2,(H2,16,18,19)
InChIKeySUTUGJFKYLBVJE-UHFFFAOYSA-N
XLogP2.66
TPSA82.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.22
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dimethyl-4-(2-pyridin-3-ylethoxy)benzenesulfonamide
CID 82913485
2-methyl-4-(2-pyridin-3-ylethoxy)benzenesulfonamide
CID 82914505
2-chloro-3-(2-pyridin-3-ylethoxy)pyridine
CID 65102137
5-chloro-2-(2-pyridin-3-ylethoxy)benzaldehyde
CID 63262865
4-chloro-2-(2-pyridin-3-ylethoxy)aniline
CID 63264708
3-chloro-4-(2-pyridin-3-ylethoxy)benzoic acid
CID 63264927
2-(2-pyridin-3-ylethyl)benzenesulfonamide;hydrochloride
CID 66960528
3-chloro-4-(2-pyridin-3-ylethoxy)benzenecarboximidamide
CID 63262641
3-[2-[4-bromo-2-(chloromethyl)phenoxy]ethyl]pyridine
CID 55167870
O-(2-pyridin-3-ylethyl)hydroxylamine;dihydrochloride
CID 45158549
4-but-2-ynoxy-2,3-dichlorobenzenesulfonamide
CID 82912289
3-fluoro-4-(2-pyridin-3-ylethoxy)benzaldehyde
CID 107689567

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide?
The IUPAC name of 2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide (CID 82913767) is 2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide.
What is the SMILES notation for 2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide?
The canonical SMILES for 2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide is NS(=O)(=O)c1ccc(OCCc2cccnc2)c(Cl)c1Cl.
What is the InChIKey of 2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide?
The InChIKey is SUTUGJFKYLBVJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12Cl2N2O3S/c14-12-10(3-4-11(13(12)15)21(16,18)19)20-7-5-9-2-1-6-17-8-9/h1-4,6,8H,5,7H2,(H2,16,18,19).
What are the key properties of 2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide?
2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide has a molecular weight of 347.22 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-4-(2-pyridin-3-ylethoxy)benzenesulfonamide is sourced from PubChem (CID 82913767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).