2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol

C14H23N3O3S — CID 62144222

IUPAC2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol
SMILESCCNc1cc(S(=O)(=O)N2CCCCC2CCO)ccn1
InChIInChI=1S/C14H23N3O3S/c1-2-15-14-11-13(6-8-16-14)21(19,20)17-9-4-3-5-12(17)7-10-18/h6,8,11-12,18H,2-5,7,9-10H2,1H3,(H,15,16)
InChIKeyXPSINUQGZRIRHU-UHFFFAOYSA-N
MW313.42 g/mol
LogP1.44
Rot. Bonds6

About 2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol

2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol (PubChem CID 62144222) has the molecular formula C14H23N3O3S and a molecular weight of 313.42 g/mol. Its IUPAC name is 2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol
PubChem CID62144222
Molecular FormulaC14H23N3O3S
Molecular Weight313.42 g/mol
Exact Mass313.15
IUPAC Name2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol
SMILESCCNc1cc(S(=O)(=O)N2CCCCC2CCO)ccn1
InChIInChI=1S/C14H23N3O3S/c1-2-15-14-11-13(6-8-16-14)21(19,20)17-9-4-3-5-12(17)7-10-18/h6,8,11-12,18H,2-5,7,9-10H2,1H3,(H,15,16)
InChIKeyXPSINUQGZRIRHU-UHFFFAOYSA-N
XLogP1.44
TPSA82.53 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.42
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]-3-methylpyrrolidin-2-yl]methanol
CID 102789194
1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]pyrrolidin-3-ol
CID 62942337
[1-[2-(ethylamino)-4-pyridinyl]azepan-2-yl]methanol
CID 116640751
2-amino-4-[2-(2-hydroxyethyl)piperidin-1-yl]sulfonylphenol
CID 43104623
4-(4-cyclopropylpiperazin-1-yl)sulfonyl-N-ethylpyridin-2-amine
CID 62152286
2-[1-(4-chlorophenyl)sulfonylpiperidin-2-yl]ethanol
CID 54878321
[1-[[2-(ethylamino)-4-pyridinyl]methyl]azepan-2-yl]methanol
CID 116637998
4-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylsulfonyl)-N-ethylpyridin-2-amine
CID 79933811
5-[2-(2-hydroxyethyl)piperidin-1-yl]sulfonyl-3-methyl-1,3-benzoxazol-2-one
CID 146025002
N-ethyl-4-(3-methoxypyrrolidin-1-yl)sulfonylpyridin-2-amine
CID 103538318
N-ethyl-4-[(1-oxo-1,4-thiazinan-4-yl)sulfonyl]pyridin-2-amine
CID 55043507
[1-[[2-(propylamino)-4-pyridinyl]sulfonyl]piperidin-4-yl]methanol
CID 62164530

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol?
The IUPAC name of 2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol (CID 62144222) is 2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol.
What is the SMILES notation for 2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol?
The canonical SMILES for 2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol is CCNc1cc(S(=O)(=O)N2CCCCC2CCO)ccn1.
What is the InChIKey of 2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol?
The InChIKey is XPSINUQGZRIRHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3S/c1-2-15-14-11-13(6-8-16-14)21(19,20)17-9-4-3-5-12(17)7-10-18/h6,8,11-12,18H,2-5,7,9-10H2,1H3,(H,15,16).
What are the key properties of 2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol?
2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol has a molecular weight of 313.42 g/mol, XLogP of 1.44, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[2-(ethylamino)-4-pyridinyl]sulfonyl]piperidin-2-yl]ethanol is sourced from PubChem (CID 62144222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).