[1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol

C12H19N3O3S — CID 103305482

IUPAC[1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol
SMILESCNc1cccnc1S(=O)(=O)N1CCCCC1CO
InChIInChI=1S/C12H19N3O3S/c1-13-11-6-4-7-14-12(11)19(17,18)15-8-3-2-5-10(15)9-16/h4,6-7,10,13,16H,2-3,5,8-9H2,1H3
InChIKeyYPKAKORRFYUFCK-UHFFFAOYSA-N
MW285.37 g/mol
LogP0.66
Rot. Bonds4

About [1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol

[1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol (PubChem CID 103305482) has the molecular formula C12H19N3O3S and a molecular weight of 285.37 g/mol. Its IUPAC name is [1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol.

Molecular Properties

Compound Name[1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol
PubChem CID103305482
Molecular FormulaC12H19N3O3S
Molecular Weight285.37 g/mol
Exact Mass285.11
IUPAC Name[1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol
SMILESCNc1cccnc1S(=O)(=O)N1CCCCC1CO
InChIInChI=1S/C12H19N3O3S/c1-13-11-6-4-7-14-12(11)19(17,18)15-8-3-2-5-10(15)9-16/h4,6-7,10,13,16H,2-3,5,8-9H2,1H3
InChIKeyYPKAKORRFYUFCK-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

[1-[[2-(methylamino)-3-pyridinyl]sulfonyl]pyrrolidin-2-yl]methanol
CID 55139274
N-methyl-2-pyrrolidin-1-ylsulfonylpyridin-3-amine
CID 103303592
1-[1-[(3-fluoro-2-pyridinyl)sulfonyl]piperidin-2-yl]-N-methylmethanamine
CID 103302482
2-[1-[(3-fluoro-2-pyridinyl)sulfonyl]piperidin-2-yl]-N-methylethanamine
CID 103302532
1-[1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-4-yl]ethanol
CID 106837532
[1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]pyrrolidin-2-yl]methanol
CID 62157239
[4-[[3-(methylamino)-2-pyridinyl]sulfonyl]morpholin-2-yl]methanol
CID 103306627
N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine
CID 103302961
[1-[2-(propylamino)phenyl]sulfonylpiperidin-2-yl]methanol
CID 62151316
N-methyl-2-(2-propylpiperidin-1-yl)sulfonylaniline
CID 83062064
[2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylsulfonyl)-3-pyridinyl]hydrazine
CID 103301021
[(2S)-1-[(3-nitro-2-pyridinyl)sulfonyl]piperidin-2-yl]methanamine
CID 97165430

Frequently Asked Questions

What is the IUPAC name of [1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol?
The IUPAC name of [1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol (CID 103305482) is [1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol.
What is the SMILES notation for [1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol?
The canonical SMILES for [1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol is CNc1cccnc1S(=O)(=O)N1CCCCC1CO.
What is the InChIKey of [1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol?
The InChIKey is YPKAKORRFYUFCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3S/c1-13-11-6-4-7-14-12(11)19(17,18)15-8-3-2-5-10(15)9-16/h4,6-7,10,13,16H,2-3,5,8-9H2,1H3.
What are the key properties of [1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol?
[1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol 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-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol is sourced from PubChem (CID 103305482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).