2-ethoxy-5-piperidin-1-ylsulfonylpyridine

C12H18N2O3S — CID 5268013

IUPAC2-ethoxy-5-piperidin-1-ylsulfonylpyridine
SMILESCCOc1ccc(S(=O)(=O)N2CCCCC2)cn1
InChIInChI=1S/C12H18N2O3S/c1-2-17-12-7-6-11(10-13-12)18(15,16)14-8-4-3-5-9-14/h6-7,10H,2-5,8-9H2,1H3
InChIKeyABOKQLSIGJDIIP-UHFFFAOYSA-N
MW270.35 g/mol
LogP1.65
Rot. Bonds4

About 2-ethoxy-5-piperidin-1-ylsulfonylpyridine

2-ethoxy-5-piperidin-1-ylsulfonylpyridine (PubChem CID 5268013) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is 2-ethoxy-5-piperidin-1-ylsulfonylpyridine.

Molecular Properties

Compound Name2-ethoxy-5-piperidin-1-ylsulfonylpyridine
PubChem CID5268013
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC Name2-ethoxy-5-piperidin-1-ylsulfonylpyridine
SMILESCCOc1ccc(S(=O)(=O)N2CCCCC2)cn1
InChIInChI=1S/C12H18N2O3S/c1-2-17-12-7-6-11(10-13-12)18(15,16)14-8-4-3-5-9-14/h6-7,10H,2-5,8-9H2,1H3
InChIKeyABOKQLSIGJDIIP-UHFFFAOYSA-N
XLogP1.65
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-5-piperidin-1-ylsulfonylpyridine
CID 5268012
5-pyrrolidin-1-ylsulfonyl-2-(2,2,2-trifluoroethoxy)pyridine
CID 75448158
2-propan-2-yloxy-5-pyrrolidin-1-ylsulfonylpyridine
CID 5268219
1-[(6-ethoxy-3-pyridinyl)sulfonyl]pyrrolidine-3-thiol
CID 88954919
2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine
CID 97348801
ethyl 4-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)oxy]benzoate
CID 25342701
1-(4-ethoxyphenyl)-2-[(5-piperidin-1-ylsulfonyl-2-pyridinyl)sulfanyl]ethanone
CID 38969543
5-(2,3-dimethylpyrrolidin-1-yl)sulfonyl-2-ethoxypyridine
CID 84599573
N-(4-ethoxyphenyl)-5-pyrrolidin-1-ylsulfonylpyridin-2-amine
CID 5268213
4-[(5-piperidin-1-ylsulfonyl-2-pyridinyl)oxy]benzonitrile
CID 24978821
(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine
CID 114613060
1-(3-ethoxy-4-fluorophenyl)sulfonylazepane
CID 935230

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-5-piperidin-1-ylsulfonylpyridine?
The IUPAC name of 2-ethoxy-5-piperidin-1-ylsulfonylpyridine (CID 5268013) is 2-ethoxy-5-piperidin-1-ylsulfonylpyridine.
What is the SMILES notation for 2-ethoxy-5-piperidin-1-ylsulfonylpyridine?
The canonical SMILES for 2-ethoxy-5-piperidin-1-ylsulfonylpyridine is CCOc1ccc(S(=O)(=O)N2CCCCC2)cn1.
What is the InChIKey of 2-ethoxy-5-piperidin-1-ylsulfonylpyridine?
The InChIKey is ABOKQLSIGJDIIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-2-17-12-7-6-11(10-13-12)18(15,16)14-8-4-3-5-9-14/h6-7,10H,2-5,8-9H2,1H3.
What are the key properties of 2-ethoxy-5-piperidin-1-ylsulfonylpyridine?
2-ethoxy-5-piperidin-1-ylsulfonylpyridine has a molecular weight of 270.35 g/mol, XLogP of 1.65, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-5-piperidin-1-ylsulfonylpyridine is sourced from PubChem (CID 5268013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).