N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine

C13H21N3O2S — CID 62148841

IUPACN-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine
SMILESCCNc1ncccc1S(=O)(=O)N1CCCC(C)C1
InChIInChI=1S/C13H21N3O2S/c1-3-14-13-12(7-4-8-15-13)19(17,18)16-9-5-6-11(2)10-16/h4,7-8,11H,3,5-6,9-10H2,1-2H3,(H,14,15)
InChIKeyXGQZAFULMOPNDC-UHFFFAOYSA-N
MW283.40 g/mol
LogP1.93
Rot. Bonds4

About N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine

N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine (PubChem CID 62148841) has the molecular formula C13H21N3O2S and a molecular weight of 283.40 g/mol. Its IUPAC name is N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine
PubChem CID62148841
Molecular FormulaC13H21N3O2S
Molecular Weight283.40 g/mol
Exact Mass283.14
IUPAC NameN-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine
SMILESCCNc1ncccc1S(=O)(=O)N1CCCC(C)C1
InChIInChI=1S/C13H21N3O2S/c1-3-14-13-12(7-4-8-15-13)19(17,18)16-9-5-6-11(2)10-16/h4,7-8,11H,3,5-6,9-10H2,1-2H3,(H,14,15)
InChIKeyXGQZAFULMOPNDC-UHFFFAOYSA-N
XLogP1.93
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol
CID 55043660
N-ethyl-3-[3-(methoxymethyl)piperidin-1-yl]sulfonylpyridin-2-amine
CID 106588741
1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]-4-methylpiperidin-3-ol
CID 102964473
N-ethyl-3-(4-ethyl-3-methylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 63605654
3-(3-ethylpiperidin-1-yl)sulfonyl-N-methylpyridin-2-amine
CID 62146476
N-ethyl-3-(4-methylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 55043901
3-(2,3,3a,4,5,6,7,7a-octahydroindol-1-ylsulfonyl)-N-ethylpyridin-2-amine
CID 82752813
[1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]pyrrolidin-2-yl]methanol
CID 62157239
2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine
CID 103303754
N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 62148584
1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]-4-methylpiperidin-4-ol
CID 81108237
3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine
CID 62150305

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine?
The IUPAC name of N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine (CID 62148841) is N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine.
What is the SMILES notation for N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine?
The canonical SMILES for N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine is CCNc1ncccc1S(=O)(=O)N1CCCC(C)C1.
What is the InChIKey of N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine?
The InChIKey is XGQZAFULMOPNDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2S/c1-3-14-13-12(7-4-8-15-13)19(17,18)16-9-5-6-11(2)10-16/h4,7-8,11H,3,5-6,9-10H2,1-2H3,(H,14,15).
What are the key properties of N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine?
N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine has a molecular weight of 283.40 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine is sourced from PubChem (CID 62148841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).