4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide

C18H16N2O4S — CID 1281364

IUPAC4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide
SMILESCOc1ccccc1Oc1ccc(S(=O)(=O)Nc2cccnc2)cc1
InChIInChI=1S/C18H16N2O4S/c1-23-17-6-2-3-7-18(17)24-15-8-10-16(11-9-15)25(21,22)20-14-5-4-12-19-13-14/h2-13,20H,1H3
InChIKeyYPBLFFVWZZGYBR-UHFFFAOYSA-N
MW356.40 g/mol
LogP3.68
Rot. Bonds6

About 4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide

4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide (PubChem CID 1281364) has the molecular formula C18H16N2O4S and a molecular weight of 356.40 g/mol. Its IUPAC name is 4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide.

Molecular Properties

Compound Name4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide
PubChem CID1281364
Molecular FormulaC18H16N2O4S
Molecular Weight356.40 g/mol
Exact Mass356.08
IUPAC Name4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide
SMILESCOc1ccccc1Oc1ccc(S(=O)(=O)Nc2cccnc2)cc1
InChIInChI=1S/C18H16N2O4S/c1-23-17-6-2-3-7-18(17)24-15-8-10-16(11-9-15)25(21,22)20-14-5-4-12-19-13-14/h2-13,20H,1H3
InChIKeyYPBLFFVWZZGYBR-UHFFFAOYSA-N
XLogP3.68
TPSA77.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,4-Dimethoxy-N-pyridin-3-ylmethyl-benzenesulfonamide
CID 1141964
2,2,2-Trifluoro-N-(4-(2-methoxyphenoxy)phenyl)-N-(3-pyridinylmethyl)ethanesulfonamide
CID 9825084
3,4-Dimethoxy-N-pyridin-3-yl-benzenesulfonamide
CID 778317
4-ethoxy-N-pyridin-3-ylbenzenesulfonamide
CID 729504
N-(pyridin-3-yl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 722533
4-Ethoxy-N-pyridin-3-ylmethyl-benzenesulfonamide
CID 741474
4-ethoxy-N-(6-methoxy-3-pyridinyl)benzenesulfonamide
CID 2424901
2-(4-Ethoxy-benzenesulfonylamino)-N-pyridin-2-ylmethyl-propionamide
CID 6493067
3,4-dimethoxy-N'-[(1Z)-1-(pyridin-4-yl)ethylidene]benzenesulfonohydrazide
CID 25237445
N-(pyridin-4-ylmethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 817443
2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-fluoroanilino]-N-(pyridin-3-ylmethyl)acetamide
CID 989151
2-[N-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-fluoroanilino]-N-(pyridin-4-ylmethyl)acetamide
CID 1306472

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide?
The IUPAC name of 4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide (CID 1281364) is 4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide.
What is the SMILES notation for 4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide?
The canonical SMILES for 4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide is COc1ccccc1Oc1ccc(S(=O)(=O)Nc2cccnc2)cc1.
What is the InChIKey of 4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide?
The InChIKey is YPBLFFVWZZGYBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O4S/c1-23-17-6-2-3-7-18(17)24-15-8-10-16(11-9-15)25(21,22)20-14-5-4-12-19-13-14/h2-13,20H,1H3.
What are the key properties of 4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide?
4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide has a molecular weight of 356.40 g/mol, XLogP of 3.68, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenoxy)-N-pyridin-3-ylbenzenesulfonamide is sourced from PubChem (CID 1281364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).