4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide

C19H19N3O3S — CID 113031714

IUPAC4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc(N(C)c3ccccc3)cn2)cc1
InChIInChI=1S/C19H19N3O3S/c1-22(15-6-4-3-5-7-15)16-8-13-19(20-14-16)21-26(23,24)18-11-9-17(25-2)10-12-18/h3-14H,1-2H3,(H,20,21)
InChIKeyWHEKNWPPDIHQCK-UHFFFAOYSA-N
MW369.45 g/mol
LogP3.66
Rot. Bonds6

About 4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide

4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide (PubChem CID 113031714) has the molecular formula C19H19N3O3S and a molecular weight of 369.45 g/mol. Its IUPAC name is 4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide
PubChem CID113031714
Molecular FormulaC19H19N3O3S
Molecular Weight369.45 g/mol
Exact Mass369.11
IUPAC Name4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc(N(C)c3ccccc3)cn2)cc1
InChIInChI=1S/C19H19N3O3S/c1-22(15-6-4-3-5-7-15)16-8-13-19(20-14-16)21-26(23,24)18-11-9-17(25-2)10-12-18/h3-14H,1-2H3,(H,20,21)
InChIKeyWHEKNWPPDIHQCK-UHFFFAOYSA-N
XLogP3.66
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.45
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-amino-2-pyridinyl)-4-methoxybenzenesulfonamide
CID 43327268
4-methoxy-N-phenylbenzenesulfonamide
CID 835273
N-(6-chloro-2-pyridinyl)-4-methoxybenzenesulfonamide
CID 113456951
4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide
CID 3857714
N-(5-methoxy-2-pyridinyl)-4-nitrobenzenesulfonamide
CID 67305769
N-[6-(2,6-dimethylanilino)-3-pyridinyl]-4-methoxybenzenesulfonamide
CID 113017219
4-methyl-N-[3-[N-methyl-4-(N-methylanilino)anilino]phenyl]benzenesulfonamide
CID 54015900
N-[5-[methyl(2-pyridin-4-ylethyl)amino]-2-pyridinyl]benzenesulfonamide
CID 113028583
N-[5-(N-ethylanilino)-2-pyridinyl]-3,4-dimethylbenzenesulfonamide
CID 113032625
N-[5-(diethylamino)-2-pyridinyl]-4-methylbenzenesulfonamide
CID 113029747
N-[5-(3,4-difluoroanilino)-2-pyridinyl]-4-methoxybenzenesulfonamide
CID 113037637
N-[6-(2,6-difluoroanilino)pyridazin-3-yl]-4-methoxybenzenesulfonamide
CID 113051596

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide?
The IUPAC name of 4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide (CID 113031714) is 4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide?
The canonical SMILES for 4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide is COc1ccc(S(=O)(=O)Nc2ccc(N(C)c3ccccc3)cn2)cc1.
What is the InChIKey of 4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide?
The InChIKey is WHEKNWPPDIHQCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3S/c1-22(15-6-4-3-5-7-15)16-8-13-19(20-14-16)21-26(23,24)18-11-9-17(25-2)10-12-18/h3-14H,1-2H3,(H,20,21).
What are the key properties of 4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide?
4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide has a molecular weight of 369.45 g/mol, XLogP of 3.66, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[5-(N-methylanilino)-2-pyridinyl]benzenesulfonamide is sourced from PubChem (CID 113031714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).