2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide

C14H16N2O2S — CID 798911

IUPAC2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide
SMILESCc1cc(C)c(S(=O)(=O)Nc2ccccn2)c(C)c1
InChIInChI=1S/C14H16N2O2S/c1-10-8-11(2)14(12(3)9-10)19(17,18)16-13-6-4-5-7-15-13/h4-9H,1-3H3,(H,15,16)
InChIKeyMAZQRAQBFNFFGC-UHFFFAOYSA-N
MW276.36 g/mol
LogP2.81
Rot. Bonds3

About 2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide

2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide (PubChem CID 798911) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is 2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide.

Molecular Properties

Compound Name2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide
PubChem CID798911
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC Name2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide
SMILESCc1cc(C)c(S(=O)(=O)Nc2ccccn2)c(C)c1
InChIInChI=1S/C14H16N2O2S/c1-10-8-11(2)14(12(3)9-10)19(17,18)16-13-6-4-5-7-15-13/h4-9H,1-3H3,(H,15,16)
InChIKeyMAZQRAQBFNFFGC-UHFFFAOYSA-N
XLogP2.81
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Sulfapyridine
CID 5336
1-[(4-Methylphenyl)sulfonyl]-4-(2-pyridinyl)piperazine
CID 735815
1-(4-Methylbenzenesulfonyl)-4-[3-(trifluoromethyl)pyridin-2-yl]piperazine
CID 1484979
1-Guanidino-7-sulphamoylisoquinoline
CID 16658352
4-Pyridin-3-ylbenzenesulfonamide
CID 110453853
2,4,6-trimethyl-N-(3-pyridinylmethyl)benzenesulfonamide
CID 676052
N-(4-Methyl-2-pyridyl)benzenesulfonamide
CID 739341
4-methyl-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 795996
2,3,4-trimethyl-N-(4-pyridinylmethyl)benzenesulfonamide
CID 1080609
N-[5-(trifluoromethyl)pyridin-2-yl]benzenesulfonamide
CID 2815858
4-methyl-N-(pyridin-4-ylmethyl)benzenesulfonamide
CID 651192
4-Methyl-N-pyridin-2-YL-benzenesulfonamide
CID 402911

Frequently Asked Questions

What is the IUPAC name of 2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide?
The IUPAC name of 2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide (CID 798911) is 2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide.
What is the SMILES notation for 2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide?
The canonical SMILES for 2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide is Cc1cc(C)c(S(=O)(=O)Nc2ccccn2)c(C)c1.
What is the InChIKey of 2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide?
The InChIKey is MAZQRAQBFNFFGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-10-8-11(2)14(12(3)9-10)19(17,18)16-13-6-4-5-7-15-13/h4-9H,1-3H3,(H,15,16).
What are the key properties of 2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide?
2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide has a molecular weight of 276.36 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-trimethyl-N-pyridin-2-ylbenzenesulfonamide is sourced from PubChem (CID 798911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).