2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide

C14H16N2O3S — CID 16645028

IUPAC2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide
SMILESCOc1cc(C)c(C)cc1S(=O)(=O)Nc1ccccn1
InChIInChI=1S/C14H16N2O3S/c1-10-8-12(19-3)13(9-11(10)2)20(17,18)16-14-6-4-5-7-15-14/h4-9H,1-3H3,(H,15,16)
InChIKeyAGUPVYMJDTXYRU-UHFFFAOYSA-N
MW292.36 g/mol
LogP2.51
Rot. Bonds4

About 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide

2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide (PubChem CID 16645028) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide.

Molecular Properties

Compound Name2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide
PubChem CID16645028
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC Name2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide
SMILESCOc1cc(C)c(C)cc1S(=O)(=O)Nc1ccccn1
InChIInChI=1S/C14H16N2O3S/c1-10-8-12(19-3)13(9-11(10)2)20(17,18)16-14-6-4-5-7-15-14/h4-9H,1-3H3,(H,15,16)
InChIKeyAGUPVYMJDTXYRU-UHFFFAOYSA-N
XLogP2.51
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methoxy-N-pyridin-2-ylnaphthalene-2-sulfonamide
CID 747350
N-(4-ethyl-2-pyridinyl)-2,3-dihydro-1-benzofuran-5-sulfonamide
CID 2812532
4-Methoxy-naphthalene-1-sulfonic acid (3-methyl-pyridin-2-yl)-amide
CID 2992209
6-[2-(4-Methoxyphenyl)ethylamino]pyridine-3-sulfonamide
CID 9405815
N-(5-Chloro-pyridin-2-yl)-5-isopropyl-2-methoxy-benzenesulfonamide
CID 648225
2-methoxy-5-propan-2-yl-N-(2-pyridinyl)benzenesulfonamide
CID 977116
4-ethoxy-N-(3-methylpyridin-2-yl)naphthalene-1-sulfonamide
CID 1073731
[(2-Methoxy-4-methylphenyl)sulfonyl]-3-pyridylamine
CID 47001115
4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N,N-dimethyl-benzenesulfonamide
CID 53312065
4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N-methyl-benzenesulfonamide
CID 53312148
3-(6-Methoxy-3-pyridyl)-5-[4-methylsulfonyl-2-(trifluoromethyl)phenyl]pyridin-2-amine
CID 53312322
4-Methoxy-biphenyl-3-sulfonic acid pyridin-3-ylamide
CID 56684231

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide?
The IUPAC name of 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide (CID 16645028) is 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide.
What is the SMILES notation for 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide?
The canonical SMILES for 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide is COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccccn1.
What is the InChIKey of 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide?
The InChIKey is AGUPVYMJDTXYRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-10-8-12(19-3)13(9-11(10)2)20(17,18)16-14-6-4-5-7-15-14/h4-9H,1-3H3,(H,15,16).
What are the key properties of 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide?
2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide has a molecular weight of 292.36 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4,5-dimethyl-N-pyridin-2-ylbenzenesulfonamide is sourced from PubChem (CID 16645028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).