2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine

C13H20N2O3S — CID 97348801

IUPAC2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine
SMILESCCOc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cn1
InChIInChI=1S/C13H20N2O3S/c1-3-18-13-8-7-12(10-14-13)19(16,17)15-9-5-4-6-11(15)2/h7-8,10-11H,3-6,9H2,1-2H3/t11-/m1/s1
InChIKeyLRYMWWJAZILWFD-LLVKDONJSA-N
MW284.38 g/mol
LogP2.04
Rot. Bonds4

About 2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine

2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine (PubChem CID 97348801) has the molecular formula C13H20N2O3S and a molecular weight of 284.38 g/mol. Its IUPAC name is 2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine.

Molecular Properties

Compound Name2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine
PubChem CID97348801
Molecular FormulaC13H20N2O3S
Molecular Weight284.38 g/mol
Exact Mass284.12
IUPAC Name2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine
SMILESCCOc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cn1
InChIInChI=1S/C13H20N2O3S/c1-3-18-13-8-7-12(10-14-13)19(16,17)15-9-5-4-6-11(15)2/h7-8,10-11H,3-6,9H2,1-2H3/t11-/m1/s1
InChIKeyLRYMWWJAZILWFD-LLVKDONJSA-N
XLogP2.04
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-1-(4-ethoxyphenyl)sulfonyl-2-methylpiperidine
CID 847002
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CID 84599573
2-ethoxy-5-piperidin-1-ylsulfonylpyridine
CID 5268013
1-[(6-ethoxy-3-pyridinyl)sulfonyl]pyrrolidine-3-thiol
CID 88954919
(2S)-2-methyl-1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperidine
CID 1168281
2-methyl-1-(4-propylphenyl)sulfonylpiperidine
CID 17375823
(2S)-1-(4-chlorophenyl)sulfonyl-2-methylpiperidine
CID 668791
2-methyl-1-(1H-pyrazol-4-ylsulfonyl)piperidine
CID 60928789
2-chloro-5-(2-methylpyrrolidin-1-yl)sulfonylpyrimidine
CID 60974393
2-methyl-1-(4-pentylphenyl)sulfonylpiperidine
CID 3419634
N-[(2-ethoxy-4-pyridinyl)methyl]-3-(2-methylpiperidin-1-yl)sulfonylbenzamide
CID 55707761
(2R)-1-(4-ethoxynaphthalen-1-yl)sulfonyl-2-methylpiperidine
CID 760946

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine?
The IUPAC name of 2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine (CID 97348801) is 2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine.
What is the SMILES notation for 2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine?
The canonical SMILES for 2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine is CCOc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cn1.
What is the InChIKey of 2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine?
The InChIKey is LRYMWWJAZILWFD-LLVKDONJSA-N. The full InChI is InChI=1S/C13H20N2O3S/c1-3-18-13-8-7-12(10-14-13)19(16,17)15-9-5-4-6-11(15)2/h7-8,10-11H,3-6,9H2,1-2H3/t11-/m1/s1.
What are the key properties of 2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine?
2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine has a molecular weight of 284.38 g/mol, XLogP of 2.04, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-5-[(2R)-2-methylpiperidin-1-yl]sulfonylpyridine is sourced from PubChem (CID 97348801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).