2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine

C14H23N3O2S — CID 103303754

IUPAC2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine
SMILESCCCNc1cccnc1S(=O)(=O)N1CCCC(C)C1
InChIInChI=1S/C14H23N3O2S/c1-3-8-15-13-7-4-9-16-14(13)20(18,19)17-10-5-6-12(2)11-17/h4,7,9,12,15H,3,5-6,8,10-11H2,1-2H3
InChIKeyHOXHEGNOQXULJP-UHFFFAOYSA-N
MW297.42 g/mol
LogP2.32
Rot. Bonds5

About 2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine

2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine (PubChem CID 103303754) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is 2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine.

Molecular Properties

Compound Name2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine
PubChem CID103303754
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC Name2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine
SMILESCCCNc1cccnc1S(=O)(=O)N1CCCC(C)C1
InChIInChI=1S/C14H23N3O2S/c1-3-8-15-13-7-4-9-16-14(13)20(18,19)17-10-5-6-12(2)11-17/h4,7,9,12,15H,3,5-6,8,10-11H2,1-2H3
InChIKeyHOXHEGNOQXULJP-UHFFFAOYSA-N
XLogP2.32
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
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

1-[[3-(propylamino)-2-pyridinyl]sulfonyl]piperidin-3-ol
CID 103305498
2-(4-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine
CID 103303589
2-(4,4-dimethylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine
CID 103305844
2-(2-ethylthiomorpholin-4-yl)sulfonyl-N-propylpyridin-3-amine
CID 103307678
N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine
CID 62148841
4-methyl-1-[[3-(propylamino)-2-pyridinyl]sulfonyl]piperidin-4-ol
CID 103306620
2-(2-ethyl-5-methylpyrrolidin-1-yl)sulfonyl-N-propylpyridin-3-amine
CID 103306947
2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine
CID 103306376
N-ethyl-2-(3-propan-2-ylpyrrolidin-1-yl)sulfonylpyridin-3-amine
CID 103307176
2-(2,2-dimethylmorpholin-4-yl)sulfonyl-N-propylpyridin-3-amine
CID 103304816
N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine
CID 103302961
3-fluoro-2-(3-methylpyrrolidin-1-yl)sulfonylpyridine
CID 103299830

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine?
The IUPAC name of 2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine (CID 103303754) is 2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine.
What is the SMILES notation for 2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine?
The canonical SMILES for 2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine is CCCNc1cccnc1S(=O)(=O)N1CCCC(C)C1.
What is the InChIKey of 2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine?
The InChIKey is HOXHEGNOQXULJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-3-8-15-13-7-4-9-16-14(13)20(18,19)17-10-5-6-12(2)11-17/h4,7,9,12,15H,3,5-6,8,10-11H2,1-2H3.
What are the key properties of 2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine?
2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine has a molecular weight of 297.42 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine is sourced from PubChem (CID 103303754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).