2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid

C10H14N2O5S — CID 122673128

IUPAC2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid
SMILESCCc1nc(NS(C)(=O)=O)ccc1OCC(=O)O
InChIInChI=1S/C10H14N2O5S/c1-3-7-8(17-6-10(13)14)4-5-9(11-7)12-18(2,15)16/h4-5H,3,6H2,1-2H3,(H,11,12)(H,13,14)
InChIKeySRPBWEVARZMNOJ-UHFFFAOYSA-N
MW274.30 g/mol
LogP0.48
Rot. Bonds6

About 2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid

2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid (PubChem CID 122673128) has the molecular formula C10H14N2O5S and a molecular weight of 274.30 g/mol. Its IUPAC name is 2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid.

Molecular Properties

Compound Name2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid
PubChem CID122673128
Molecular FormulaC10H14N2O5S
Molecular Weight274.30 g/mol
Exact Mass274.06
IUPAC Name2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid
SMILESCCc1nc(NS(C)(=O)=O)ccc1OCC(=O)O
InChIInChI=1S/C10H14N2O5S/c1-3-7-8(17-6-10(13)14)4-5-9(11-7)12-18(2,15)16/h4-5H,3,6H2,1-2H3,(H,11,12)(H,13,14)
InChIKeySRPBWEVARZMNOJ-UHFFFAOYSA-N
XLogP0.48
TPSA105.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid?
The IUPAC name of 2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid (CID 122673128) is 2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid.
What is the SMILES notation for 2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid?
The canonical SMILES for 2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid is CCc1nc(NS(C)(=O)=O)ccc1OCC(=O)O.
What is the InChIKey of 2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid?
The InChIKey is SRPBWEVARZMNOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O5S/c1-3-7-8(17-6-10(13)14)4-5-9(11-7)12-18(2,15)16/h4-5H,3,6H2,1-2H3,(H,11,12)(H,13,14).
What are the key properties of 2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid?
2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid has a molecular weight of 274.30 g/mol, XLogP of 0.48, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-ethyl-6-(methanesulfonamido)-3-pyridinyl]oxy]acetic acid is sourced from PubChem (CID 122673128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).