N-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine

C10H16N2O2S — CID 123308816

IUPACN-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine
SMILESCCN(C)c1cnc(S(C)(=O)=O)cc1C
InChIInChI=1S/C10H16N2O2S/c1-5-12(3)9-7-11-10(6-8(9)2)15(4,13)14/h6-7H,5H2,1-4H3
InChIKeyNSUGYDATZIFWBB-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.25
Rot. Bonds3

About N-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine

N-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine (PubChem CID 123308816) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is N-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine.

Molecular Properties

Compound NameN-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine
PubChem CID123308816
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC NameN-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine
SMILESCCN(C)c1cnc(S(C)(=O)=O)cc1C
InChIInChI=1S/C10H16N2O2S/c1-5-12(3)9-7-11-10(6-8(9)2)15(4,13)14/h6-7H,5H2,1-4H3
InChIKeyNSUGYDATZIFWBB-UHFFFAOYSA-N
XLogP1.25
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine?
The IUPAC name of N-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine (CID 123308816) is N-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine.
What is the SMILES notation for N-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine?
The canonical SMILES for N-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine is CCN(C)c1cnc(S(C)(=O)=O)cc1C.
What is the InChIKey of N-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine?
The InChIKey is NSUGYDATZIFWBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-5-12(3)9-7-11-10(6-8(9)2)15(4,13)14/h6-7H,5H2,1-4H3.
What are the key properties of N-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine?
N-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine has a molecular weight of 228.32 g/mol, XLogP of 1.25, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,4-dimethyl-6-methylsulfonylpyridin-3-amine is sourced from PubChem (CID 123308816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).