N-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide

C14H23N3O2S — CID 86797227

IUPACN-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide
SMILESCCN(C1CCN(c2cccc(C)n2)CC1)S(C)(=O)=O
InChIInChI=1S/C14H23N3O2S/c1-4-17(20(3,18)19)13-8-10-16(11-9-13)14-7-5-6-12(2)15-14/h5-7,13H,4,8-11H2,1-3H3
InChIKeyGDDWHSNVGBIOBV-UHFFFAOYSA-N
MW297.42 g/mol
LogP1.64
Rot. Bonds4

About N-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide

N-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide (PubChem CID 86797227) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is N-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide.

Molecular Properties

Compound NameN-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide
PubChem CID86797227
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC NameN-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide
SMILESCCN(C1CCN(c2cccc(C)n2)CC1)S(C)(=O)=O
InChIInChI=1S/C14H23N3O2S/c1-4-17(20(3,18)19)13-8-10-16(11-9-13)14-7-5-6-12(2)15-14/h5-7,13H,4,8-11H2,1-3H3
InChIKeyGDDWHSNVGBIOBV-UHFFFAOYSA-N
XLogP1.64
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide?
The IUPAC name of N-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide (CID 86797227) is N-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide.
What is the SMILES notation for N-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide?
The canonical SMILES for N-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide is CCN(C1CCN(c2cccc(C)n2)CC1)S(C)(=O)=O.
What is the InChIKey of N-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide?
The InChIKey is GDDWHSNVGBIOBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-4-17(20(3,18)19)13-8-10-16(11-9-13)14-7-5-6-12(2)15-14/h5-7,13H,4,8-11H2,1-3H3.
What are the key properties of N-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide?
N-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide has a molecular weight of 297.42 g/mol, XLogP of 1.64, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]methanesulfonamide is sourced from PubChem (CID 86797227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).