N-methyl-6-methylsulfonyl-4-propylpyridin-2-amine

C10H16N2O2S — CID 174627125

IUPACN-methyl-6-methylsulfonyl-4-propylpyridin-2-amine
SMILESCCCc1cc(NC)nc(S(C)(=O)=O)c1
InChIInChI=1S/C10H16N2O2S/c1-4-5-8-6-9(11-2)12-10(7-8)15(3,13)14/h6-7H,4-5H2,1-3H3,(H,11,12)
InChIKeyTVGFWJIJEPPNST-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.48
Rot. Bonds4

About N-methyl-6-methylsulfonyl-4-propylpyridin-2-amine

N-methyl-6-methylsulfonyl-4-propylpyridin-2-amine (PubChem CID 174627125) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is N-methyl-6-methylsulfonyl-4-propylpyridin-2-amine.

Molecular Properties

Compound NameN-methyl-6-methylsulfonyl-4-propylpyridin-2-amine
PubChem CID174627125
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC NameN-methyl-6-methylsulfonyl-4-propylpyridin-2-amine
SMILESCCCc1cc(NC)nc(S(C)(=O)=O)c1
InChIInChI=1S/C10H16N2O2S/c1-4-5-8-6-9(11-2)12-10(7-8)15(3,13)14/h6-7H,4-5H2,1-3H3,(H,11,12)
InChIKeyTVGFWJIJEPPNST-UHFFFAOYSA-N
XLogP1.48
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-methylsulfonyl-4-propylpyridin-2-amine?
The IUPAC name of N-methyl-6-methylsulfonyl-4-propylpyridin-2-amine (CID 174627125) is N-methyl-6-methylsulfonyl-4-propylpyridin-2-amine.
What is the SMILES notation for N-methyl-6-methylsulfonyl-4-propylpyridin-2-amine?
The canonical SMILES for N-methyl-6-methylsulfonyl-4-propylpyridin-2-amine is CCCc1cc(NC)nc(S(C)(=O)=O)c1.
What is the InChIKey of N-methyl-6-methylsulfonyl-4-propylpyridin-2-amine?
The InChIKey is TVGFWJIJEPPNST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-4-5-8-6-9(11-2)12-10(7-8)15(3,13)14/h6-7H,4-5H2,1-3H3,(H,11,12).
What are the key properties of N-methyl-6-methylsulfonyl-4-propylpyridin-2-amine?
N-methyl-6-methylsulfonyl-4-propylpyridin-2-amine has a molecular weight of 228.32 g/mol, XLogP of 1.48, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-methylsulfonyl-4-propylpyridin-2-amine is sourced from PubChem (CID 174627125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).