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

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Related Compounds

4-tert-butyl-N-(6-methylpyridin-2-yl)benzenesulfonamide
CID 815224
N-(Pyridin-2-yl) arylsulfonamide, 12
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2,4-Diaminopyrimidine-based antagonist, 4c
CID 11538533
3-[(4-Methylphenyl)sulfonyl]-2-quinolinylamine
CID 1478074
N-sec-butyl-4-(4-(methylsulfonyl)phenyl)-6-(trifluoromethyl)pyrimidin-2-amine
CID 45268661
N-(4,6-dimethyl-2-pyridinyl)-4-(2-methylpropyl)benzenesulfonamide
CID 778279
N,4-dimethyl-3-(methylsulfonyl)-6-phenyl-2-pyridinamine
CID 1488750
N-(6-Methyl-pyridin-2-yl)-2-(toluene-4-sulfonyl)-acetamide
CID 3163423
N-mesityl-6-methyl-3-tosylpyridin-2-amine
CID 11245983
3-(4-ethylphenylsulfonyl)-N-mesityl-6-methylpyridin-2-amine
CID 11418006
5-(4-(4-(Methylsulfonyl)benzylamino)phenyl)-6-hexylpyrimidine-2,4-diamine
CID 44409809
5-(4-(4-(methylsulfonyl)benzylamino)phenyl)-6-ethyl-N4-methylpyrimidine-2,4-diamine
CID 44409975

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).