2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid

C11H15NO3 — CID 83884295

IUPAC2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid
SMILESCC(C)Oc1cc(C(C)C(=O)O)ccn1
InChIInChI=1S/C11H15NO3/c1-7(2)15-10-6-9(4-5-12-10)8(3)11(13)14/h4-8H,1-3H3,(H,13,14)
InChIKeyQAXBWBCHMAVCBI-UHFFFAOYSA-N
MW209.24 g/mol
LogP2.06
Rot. Bonds4

About 2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid

2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid (PubChem CID 83884295) has the molecular formula C11H15NO3 and a molecular weight of 209.24 g/mol. Its IUPAC name is 2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid.

Molecular Properties

Compound Name2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid
PubChem CID83884295
Molecular FormulaC11H15NO3
Molecular Weight209.24 g/mol
Exact Mass209.11
IUPAC Name2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid
SMILESCC(C)Oc1cc(C(C)C(=O)O)ccn1
InChIInChI=1S/C11H15NO3/c1-7(2)15-10-6-9(4-5-12-10)8(3)11(13)14/h4-8H,1-3H3,(H,13,14)
InChIKeyQAXBWBCHMAVCBI-UHFFFAOYSA-N
XLogP2.06
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.24
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid with MolForge

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

Launch Full Analysis

Related Compounds

2-[2-(4-methylphenoxy)-4-pyridinyl]propanoic acid
CID 12945002
2-(3-propan-2-yloxyphenyl)propanoic acid
CID 67024169
2-(2-cyano-4-pyridinyl)propanoic acid
CID 22939335
1-methyl-5-propan-2-ylpyrazole;4-propan-2-yl-2-propan-2-yloxypyridine
CID 177189575
2-[4-(1-carboxyethyl)phenyl]propanoic acid
CID 601009
1-[2-(difluoromethoxy)-4-pyridinyl]ethanamine
CID 162524387
(2R)-2-(3-methoxy-4-methylphenyl)propanoic acid
CID 118199604
(2S)-2-amino-N-cyclopropyl-N-[(2-propan-2-yloxy-4-pyridinyl)methyl]propanamide
CID 99704294
methyl 2-cyclopropyl-2-(2-methoxy-4-pyridinyl)acetate
CID 175669708
4-methyl-2-(4-propan-2-yloxypyrimidin-2-yl)pentanoic acid
CID 113428025
2-(6-propan-2-yloxypyrimidin-4-yl)butanoic acid
CID 104572083
(2S)-2-(2-methoxy-4-pyridinyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid
CID 99737404

Frequently Asked Questions

What is the IUPAC name of 2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid?
The IUPAC name of 2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid (CID 83884295) is 2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid.
What is the SMILES notation for 2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid?
The canonical SMILES for 2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid is CC(C)Oc1cc(C(C)C(=O)O)ccn1.
What is the InChIKey of 2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid?
The InChIKey is QAXBWBCHMAVCBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-7(2)15-10-6-9(4-5-12-10)8(3)11(13)14/h4-8H,1-3H3,(H,13,14).
What are the key properties of 2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid?
2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid has a molecular weight of 209.24 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propan-2-yloxy-4-pyridinyl)propanoic acid is sourced from PubChem (CID 83884295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).