4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide

C14H16N2O3S — CID 2479319

IUPAC4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)NCCc2ccccn2)cc1
InChIInChI=1S/C14H16N2O3S/c1-19-13-5-7-14(8-6-13)20(17,18)16-11-9-12-4-2-3-10-15-12/h2-8,10,16H,9,11H2,1H3
InChIKeyIPSJBKBNHLRXFV-UHFFFAOYSA-N
MW292.36 g/mol
LogP1.61
Rot. Bonds6

About 4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide

4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide (PubChem CID 2479319) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is 4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide
PubChem CID2479319
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC Name4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)NCCc2ccccn2)cc1
InChIInChI=1S/C14H16N2O3S/c1-19-13-5-7-14(8-6-13)20(17,18)16-11-9-12-4-2-3-10-15-12/h2-8,10,16H,9,11H2,1H3
InChIKeyIPSJBKBNHLRXFV-UHFFFAOYSA-N
XLogP1.61
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-Dimethoxy-N-pyridin-3-ylmethyl-benzenesulfonamide
CID 1141964
Acetamide, N-hydroxy-2-[[(4-methoxyphenyl)sulfonyl](3-pyridinylmethyl)amino]-
CID 10545870
N-hydroxy-2-[(4-methoxybenzene)(pyridin-2-ylmethyl)sulfonamido]acetamide
CID 10760373
N-Hydroxy-N~2~-[(4-Methoxyphenyl)sulfonyl]-N~2~-(Pyridin-4-Ylmethyl)glycinamide
CID 10831751
(2R)-N-hydroxy-2-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]pent-4-enamide
CID 71465421
4-methoxy-N-[2-(4-pyridinyl)ethyl]benzenesulfonamide
CID 688003
1-[(4-Methoxyphenyl)sulfonyl]-4-(3-pyridylmethyl)piperazine
CID 828758
3,4-Dimethoxy-N-pyridin-3-yl-benzenesulfonamide
CID 778317
4-methoxy-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 809740
4-ethoxy-N-(pyridin-4-ylmethyl)benzenesulfonamide
CID 676047
4-ethoxy-N-pyridin-3-ylbenzenesulfonamide
CID 729504
1-[(4-methoxyphenyl)sulfonyl]-1H-pyrrole
CID 831626

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide?
The IUPAC name of 4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide (CID 2479319) is 4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide?
The canonical SMILES for 4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide is COc1ccc(S(=O)(=O)NCCc2ccccn2)cc1.
What is the InChIKey of 4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide?
The InChIKey is IPSJBKBNHLRXFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-19-13-5-7-14(8-6-13)20(17,18)16-11-9-12-4-2-3-10-15-12/h2-8,10,16H,9,11H2,1H3.
What are the key properties of 4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide?
4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide has a molecular weight of 292.36 g/mol, XLogP of 1.61, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(2-pyridin-2-ylethyl)benzenesulfonamide is sourced from PubChem (CID 2479319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).