2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine

C12H19N3O2S — CID 103307665

IUPAC2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine
SMILESCC1CCN(S(=O)(=O)c2ncccc2N)CC1C
InChIInChI=1S/C12H19N3O2S/c1-9-5-7-15(8-10(9)2)18(16,17)12-11(13)4-3-6-14-12/h3-4,6,9-10H,5,7-8,13H2,1-2H3
InChIKeyYJTSPZDGYXJYLO-UHFFFAOYSA-N
MW269.37 g/mol
LogP1.33
Rot. Bonds2

About 2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine

2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine (PubChem CID 103307665) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is 2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine.

Molecular Properties

Compound Name2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine
PubChem CID103307665
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC Name2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine
SMILESCC1CCN(S(=O)(=O)c2ncccc2N)CC1C
InChIInChI=1S/C12H19N3O2S/c1-9-5-7-15(8-10(9)2)18(16,17)12-11(13)4-3-6-14-12/h3-4,6,9-10H,5,7-8,13H2,1-2H3
InChIKeyYJTSPZDGYXJYLO-UHFFFAOYSA-N
XLogP1.33
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,4-dimethylpiperazin-1-yl)sulfonylpyridin-3-amine
CID 103306013
3-(3,4-dimethylpiperidin-1-yl)sulfonylpyridine-2-carbonitrile
CID 106546645
[2-(3-methoxy-4-methylpiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine
CID 103302177
2-(1,2,4,5-tetrahydro-3-benzazepin-3-ylsulfonyl)pyridin-3-amine
CID 103306193
3-fluoro-2-(3-methylpyrrolidin-1-yl)sulfonylpyridine
CID 103299830
[4-[(3-amino-2-pyridinyl)sulfonyl]morpholin-2-yl]methanol
CID 103306629
2-[[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]sulfonyl]pyridin-3-amine
CID 103307983
3-(3,4-dimethylpyrrolidin-1-yl)sulfonylpyridin-2-amine
CID 79188499
1-[(3-hydrazinyl-2-pyridinyl)sulfonyl]pyrrolidin-3-ol
CID 103301477
[2-(4-methylpiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine
CID 103300836
2-(3-azaspiro[5.5]undecan-3-ylsulfonyl)pyridin-3-amine
CID 103305842
4-[(3-amino-2-pyridinyl)sulfonyl]-1,4-diazepan-2-one
CID 103306320

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine?
The IUPAC name of 2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine (CID 103307665) is 2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine.
What is the SMILES notation for 2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine?
The canonical SMILES for 2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine is CC1CCN(S(=O)(=O)c2ncccc2N)CC1C.
What is the InChIKey of 2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine?
The InChIKey is YJTSPZDGYXJYLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-9-5-7-15(8-10(9)2)18(16,17)12-11(13)4-3-6-14-12/h3-4,6,9-10H,5,7-8,13H2,1-2H3.
What are the key properties of 2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine?
2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine has a molecular weight of 269.37 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylpiperidin-1-yl)sulfonylpyridin-3-amine is sourced from PubChem (CID 103307665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).