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

C10H13NO3 — CID 742711

IUPAC2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetic acid
SMILESCCc1nc(C)ccc1OCC(=O)O
InChIInChI=1S/C10H13NO3/c1-3-8-9(14-6-10(12)13)5-4-7(2)11-8/h4-5H,3,6H2,1-2H3,(H,12,13)
InChIKeyMTXHAAUHPXVFAW-UHFFFAOYSA-N
MW195.22 g/mol
LogP1.42
Rot. Bonds4

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

2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetic acid (PubChem CID 742711) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is 2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetic acid.

Molecular Properties

Compound Name2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetic acid
PubChem CID742711
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC Name2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetic acid
SMILESCCc1nc(C)ccc1OCC(=O)O
InChIInChI=1S/C10H13NO3/c1-3-8-9(14-6-10(12)13)5-4-7(2)11-8/h4-5H,3,6H2,1-2H3,(H,12,13)
InChIKeyMTXHAAUHPXVFAW-UHFFFAOYSA-N
XLogP1.42
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetic acid?
The IUPAC name of 2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetic acid (CID 742711) is 2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetic acid.
What is the SMILES notation for 2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetic acid?
The canonical SMILES for 2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetic acid is CCc1nc(C)ccc1OCC(=O)O.
What is the InChIKey of 2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetic acid?
The InChIKey is MTXHAAUHPXVFAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3/c1-3-8-9(14-6-10(12)13)5-4-7(2)11-8/h4-5H,3,6H2,1-2H3,(H,12,13).
What are the key properties of 2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetic acid?
2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetic acid has a molecular weight of 195.22 g/mol, XLogP of 1.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]acetic acid is sourced from PubChem (CID 742711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).