3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid

C8H14O4 — CID 155795469

IUPAC3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid
SMILESC[C@H]1COC(OCCC(=O)O)C1
InChIInChI=1S/C8H14O4/c1-6-4-8(12-5-6)11-3-2-7(9)10/h6,8H,2-5H2,1H3,(H,9,10)/t6-,8?/m1/s1
InChIKeyCDGFQMQDRSMVHG-XPJFZRNWSA-N
MW174.20 g/mol
LogP0.86
Rot. Bonds4

About 3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid

3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid (PubChem CID 155795469) has the molecular formula C8H14O4 and a molecular weight of 174.20 g/mol. Its IUPAC name is 3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid.

Molecular Properties

Compound Name3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid
PubChem CID155795469
Molecular FormulaC8H14O4
Molecular Weight174.20 g/mol
Exact Mass174.09
IUPAC Name3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid
SMILESC[C@H]1COC(OCCC(=O)O)C1
InChIInChI=1S/C8H14O4/c1-6-4-8(12-5-6)11-3-2-7(9)10/h6,8H,2-5H2,1H3,(H,9,10)/t6-,8?/m1/s1
InChIKeyCDGFQMQDRSMVHG-XPJFZRNWSA-N
XLogP0.86
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[(4R)-4-methyloxolan-2-yl]oxypropanoic 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

(4R)-2-butoxy-4-methyloxolane
CID 11789482
(2S,4R)-2-ethoxy-4-methyloxolane
CID 102317683
(2R,4S)-2-ethoxy-4-methyloxolane
CID 10558657
butanedioic acid;2-methyloxirane
CID 87390185
butanoic acid;2-methyloxirane
CID 159918705
3-[(4-methyloxolan-2-yl)oxymethyl]oxolan-2-one
CID 129024772
3-cyclopentyloxypropanoic acid
CID 24706641
(4R)-2-[(3,5-dichlorophenyl)methoxy]-4-methyloxolane
CID 155795666
methyl 3-(3-methylcyclobutyl)oxypropanoate
CID 170036663
6-(3,4-dimethylcyclohexyl)oxyhexanoic acid
CID 64747074
3-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropanoic acid
CID 67448789
3-[[(2S,4S)-4-methylpyrrolidin-2-yl]methoxy]propanoic acid
CID 169177331

Frequently Asked Questions

What is the IUPAC name of 3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid?
The IUPAC name of 3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid (CID 155795469) is 3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid.
What is the SMILES notation for 3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid?
The canonical SMILES for 3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid is C[C@H]1COC(OCCC(=O)O)C1.
What is the InChIKey of 3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid?
The InChIKey is CDGFQMQDRSMVHG-XPJFZRNWSA-N. The full InChI is InChI=1S/C8H14O4/c1-6-4-8(12-5-6)11-3-2-7(9)10/h6,8H,2-5H2,1H3,(H,9,10)/t6-,8?/m1/s1.
What are the key properties of 3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid?
3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid has a molecular weight of 174.20 g/mol, XLogP of 0.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4R)-4-methyloxolan-2-yl]oxypropanoic acid is sourced from PubChem (CID 155795469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).