N,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine

C15H18N2O2S — CID 1488727

IUPACN,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine
SMILESCNc1nc(C)cc(C)c1S(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C15H18N2O2S/c1-10-5-7-13(8-6-10)20(18,19)14-11(2)9-12(3)17-15(14)16-4/h5-9H,1-4H3,(H,16,17)
InChIKeyQPDWOBCJVJJMBU-UHFFFAOYSA-N
MW290.39 g/mol
LogP2.88
Rot. Bonds3

About N,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine

N,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine (PubChem CID 1488727) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is N,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine.

Molecular Properties

Compound NameN,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine
PubChem CID1488727
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC NameN,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine
SMILESCNc1nc(C)cc(C)c1S(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C15H18N2O2S/c1-10-5-7-13(8-6-10)20(18,19)14-11(2)9-12(3)17-15(14)16-4/h5-9H,1-4H3,(H,16,17)
InChIKeyQPDWOBCJVJJMBU-UHFFFAOYSA-N
XLogP2.88
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine?
The IUPAC name of N,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine (CID 1488727) is N,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine.
What is the SMILES notation for N,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine?
The canonical SMILES for N,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine is CNc1nc(C)cc(C)c1S(=O)(=O)c1ccc(C)cc1.
What is the InChIKey of N,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine?
The InChIKey is QPDWOBCJVJJMBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-10-5-7-13(8-6-10)20(18,19)14-11(2)9-12(3)17-15(14)16-4/h5-9H,1-4H3,(H,16,17).
What are the key properties of N,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine?
N,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine has a molecular weight of 290.39 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,4,6-trimethyl-3-(4-methylphenyl)sulfonylpyridin-2-amine is sourced from PubChem (CID 1488727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).