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

C16H20N2O2S — CID 1471064

IUPACN,N,4,6-tetramethyl-3-(2-methylphenyl)sulfonylpyridin-2-amine
SMILESCc1cc(C)c(S(=O)(=O)c2ccccc2C)c(N(C)C)n1
InChIInChI=1S/C16H20N2O2S/c1-11-8-6-7-9-14(11)21(19,20)15-12(2)10-13(3)17-16(15)18(4)5/h6-10H,1-5H3
InChIKeyXFSKTPMWOSZHQZ-UHFFFAOYSA-N
MW304.42 g/mol
LogP2.91
Rot. Bonds3

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

N,N,4,6-tetramethyl-3-(2-methylphenyl)sulfonylpyridin-2-amine (PubChem CID 1471064) has the molecular formula C16H20N2O2S and a molecular weight of 304.42 g/mol. Its IUPAC name is N,N,4,6-tetramethyl-3-(2-methylphenyl)sulfonylpyridin-2-amine.

Molecular Properties

Compound NameN,N,4,6-tetramethyl-3-(2-methylphenyl)sulfonylpyridin-2-amine
PubChem CID1471064
Molecular FormulaC16H20N2O2S
Molecular Weight304.42 g/mol
Exact Mass304.12
IUPAC NameN,N,4,6-tetramethyl-3-(2-methylphenyl)sulfonylpyridin-2-amine
SMILESCc1cc(C)c(S(=O)(=O)c2ccccc2C)c(N(C)C)n1
InChIInChI=1S/C16H20N2O2S/c1-11-8-6-7-9-14(11)21(19,20)15-12(2)10-13(3)17-16(15)18(4)5/h6-10H,1-5H3
InChIKeyXFSKTPMWOSZHQZ-UHFFFAOYSA-N
XLogP2.91
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N,4,6-tetramethyl-3-(2-methylphenyl)sulfonylpyridin-2-amine?
The IUPAC name of N,N,4,6-tetramethyl-3-(2-methylphenyl)sulfonylpyridin-2-amine (CID 1471064) is N,N,4,6-tetramethyl-3-(2-methylphenyl)sulfonylpyridin-2-amine.
What is the SMILES notation for N,N,4,6-tetramethyl-3-(2-methylphenyl)sulfonylpyridin-2-amine?
The canonical SMILES for N,N,4,6-tetramethyl-3-(2-methylphenyl)sulfonylpyridin-2-amine is Cc1cc(C)c(S(=O)(=O)c2ccccc2C)c(N(C)C)n1.
What is the InChIKey of N,N,4,6-tetramethyl-3-(2-methylphenyl)sulfonylpyridin-2-amine?
The InChIKey is XFSKTPMWOSZHQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2S/c1-11-8-6-7-9-14(11)21(19,20)15-12(2)10-13(3)17-16(15)18(4)5/h6-10H,1-5H3.
What are the key properties of N,N,4,6-tetramethyl-3-(2-methylphenyl)sulfonylpyridin-2-amine?
N,N,4,6-tetramethyl-3-(2-methylphenyl)sulfonylpyridin-2-amine has a molecular weight of 304.42 g/mol, XLogP of 2.91, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4,6-tetramethyl-3-(2-methylphenyl)sulfonylpyridin-2-amine is sourced from PubChem (CID 1471064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).