2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine

C14H23N3O2S — CID 103306376

IUPAC2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine
SMILESCCNc1cccnc1S(=O)(=O)N1CC(C)CCC1C
InChIInChI=1S/C14H23N3O2S/c1-4-15-13-6-5-9-16-14(13)20(18,19)17-10-11(2)7-8-12(17)3/h5-6,9,11-12,15H,4,7-8,10H2,1-3H3
InChIKeyMCOXTPJJFDYKFC-UHFFFAOYSA-N
MW297.42 g/mol
LogP2.32
Rot. Bonds4

About 2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine

2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine (PubChem CID 103306376) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is 2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine.

Molecular Properties

Compound Name2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine
PubChem CID103306376
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC Name2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine
SMILESCCNc1cccnc1S(=O)(=O)N1CC(C)CCC1C
InChIInChI=1S/C14H23N3O2S/c1-4-15-13-6-5-9-16-14(13)20(18,19)17-10-11(2)7-8-12(17)3/h5-6,9,11-12,15H,4,7-8,10H2,1-3H3
InChIKeyMCOXTPJJFDYKFC-UHFFFAOYSA-N
XLogP2.32
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine
CID 103302961
N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylsulfonyl)pyridin-3-amine
CID 103306417
2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine
CID 103303754
N-ethyl-2-(3-propan-2-ylpyrrolidin-1-yl)sulfonylpyridin-3-amine
CID 103307176
2-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-ylsulfonyl)-N-ethylpyridin-3-amine
CID 103305199
2-(4-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine
CID 103303589
2-(2-ethyl-5-methylpyrrolidin-1-yl)sulfonyl-N-propylpyridin-3-amine
CID 103306947
2-[[3-(ethylamino)-2-pyridinyl]sulfonyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-ol
CID 103307057
N-cyclopropyl-3-(ethylamino)pyridine-2-sulfonamide
CID 103303691
3-(ethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-2-sulfonamide
CID 103303867
4-[[3-(ethylamino)-2-pyridinyl]sulfonyl]morpholine-2-carbonitrile
CID 103306494
N-(1-cyclopropylpyrrolidin-3-yl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103305291

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine?
The IUPAC name of 2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine (CID 103306376) is 2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine.
What is the SMILES notation for 2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine?
The canonical SMILES for 2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine is CCNc1cccnc1S(=O)(=O)N1CC(C)CCC1C.
What is the InChIKey of 2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine?
The InChIKey is MCOXTPJJFDYKFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-4-15-13-6-5-9-16-14(13)20(18,19)17-10-11(2)7-8-12(17)3/h5-6,9,11-12,15H,4,7-8,10H2,1-3H3.
What are the key properties of 2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine?
2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine has a molecular weight of 297.42 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine is sourced from PubChem (CID 103306376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).