1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol

C12H19N3O3S — CID 55043660

IUPAC1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol
SMILESCCNc1ncccc1S(=O)(=O)N1CCCC(O)C1
InChIInChI=1S/C12H19N3O3S/c1-2-13-12-11(6-3-7-14-12)19(17,18)15-8-4-5-10(16)9-15/h3,6-7,10,16H,2,4-5,8-9H2,1H3,(H,13,14)
InChIKeyPIIQNXWDISRSRU-UHFFFAOYSA-N
MW285.37 g/mol
LogP0.66
Rot. Bonds4

About 1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol

1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol (PubChem CID 55043660) has the molecular formula C12H19N3O3S and a molecular weight of 285.37 g/mol. Its IUPAC name is 1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol.

Molecular Properties

Compound Name1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol
PubChem CID55043660
Molecular FormulaC12H19N3O3S
Molecular Weight285.37 g/mol
Exact Mass285.11
IUPAC Name1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol
SMILESCCNc1ncccc1S(=O)(=O)N1CCCC(O)C1
InChIInChI=1S/C12H19N3O3S/c1-2-13-12-11(6-3-7-14-12)19(17,18)15-8-4-5-10(16)9-15/h3,6-7,10,16H,2,4-5,8-9H2,1H3,(H,13,14)
InChIKeyPIIQNXWDISRSRU-UHFFFAOYSA-N
XLogP0.66
TPSA82.53 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-3-(3-methylpiperidin-1-yl)sulfonylpyridin-2-amine
CID 62148841
1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]-4-methylpiperidin-3-ol
CID 102964473
N-ethyl-3-[3-(methoxymethyl)piperidin-1-yl]sulfonylpyridin-2-amine
CID 106588741
[1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]pyrrolidin-2-yl]methanol
CID 62157239
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
1-[[3-(propylamino)-2-pyridinyl]sulfonyl]piperidin-3-ol
CID 103305498
N-ethyl-3-(4-methylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 55043901
1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]-4-methylpiperidin-4-ol
CID 81108237
3-(2,3,3a,4,5,6,7,7a-octahydroindol-1-ylsulfonyl)-N-ethylpyridin-2-amine
CID 82752813
N-ethyl-3-(4-propylpiperazin-1-yl)sulfonylpyridin-2-amine
CID 62148584
3-(azocan-1-ylsulfonyl)-N-propylpyridin-2-amine
CID 62150305

Frequently Asked Questions

What is the IUPAC name of 1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol?
The IUPAC name of 1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol (CID 55043660) is 1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol.
What is the SMILES notation for 1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol?
The canonical SMILES for 1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol is CCNc1ncccc1S(=O)(=O)N1CCCC(O)C1.
What is the InChIKey of 1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol?
The InChIKey is PIIQNXWDISRSRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3S/c1-2-13-12-11(6-3-7-14-12)19(17,18)15-8-4-5-10(16)9-15/h3,6-7,10,16H,2,4-5,8-9H2,1H3,(H,13,14).
What are the key properties of 1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol?
1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol has a molecular weight of 285.37 g/mol, XLogP of 0.66, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]piperidin-3-ol is sourced from PubChem (CID 55043660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).