(2R,5S)-oxolane-2,5-dicarboxylic acid

C6H8O5 — CID 12667635

IUPAC(2R,5S)-oxolane-2,5-dicarboxylic acid
SMILESO=C(O)[C@@H]1CC[C@H](C(=O)O)O1
InChIInChI=1S/C6H8O5/c7-5(8)3-1-2-4(11-3)6(9)10/h3-4H,1-2H2,(H,7,8)(H,9,10)/t3-,4+
InChIKeyCWZQRDJXBMLSTF-ZXZARUISSA-N
MW160.12 g/mol
LogP-0.30
Rot. Bonds2

About (2R,5S)-oxolane-2,5-dicarboxylic acid

(2R,5S)-oxolane-2,5-dicarboxylic acid (PubChem CID 12667635) has the molecular formula C6H8O5 and a molecular weight of 160.12 g/mol. Its IUPAC name is (2R,5S)-oxolane-2,5-dicarboxylic acid.

Molecular Properties

Compound Name(2R,5S)-oxolane-2,5-dicarboxylic acid
PubChem CID12667635
Molecular FormulaC6H8O5
Molecular Weight160.12 g/mol
Exact Mass160.04
IUPAC Name(2R,5S)-oxolane-2,5-dicarboxylic acid
SMILESO=C(O)[C@@H]1CC[C@H](C(=O)O)O1
InChIInChI=1S/C6H8O5/c7-5(8)3-1-2-4(11-3)6(9)10/h3-4H,1-2H2,(H,7,8)(H,9,10)/t3-,4+
InChIKeyCWZQRDJXBMLSTF-ZXZARUISSA-N
XLogP-0.30
TPSA83.83 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.12
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R,5S)-oxolane-2,5-dicarboxylic 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

(2S,6R)-oxane-2,6-dicarboxylic acid
CID 22804348
(2S,5S)-5-carbamoyloxolane-2-carboxylic acid
CID 97358936
(2R)-5-methyloxolane-2-carboxylic acid
CID 58055098
(2S,5R)-5-(methoxycarbamoyl)oxolane-2-carboxylic acid
CID 131204169
(2R,5S)-5-(ethylcarbamoyl)oxolane-2-carboxylic acid
CID 102944287
(2R,5S)-5-(cyclooctylcarbamoyl)oxolane-2-carboxylic acid
CID 102944337
(2R,5S)-5-[cyclopropyl(methyl)carbamoyl]oxolane-2-carboxylic acid
CID 102944218
5-(sulfanylmethyl)oxolane-2-carboxylic acid
CID 62298704
(2S)-5-methoxyoxolane-2-carboxylic acid
CID 67688190
(2R,5S)-5-(cyclopropylmethylcarbamoyl)oxolane-2-carboxylic acid
CID 102944290
(2R,5S)-5-[methyl(propan-2-yl)carbamoyl]oxolane-2-carboxylic acid
CID 102944175
5-(morpholine-4-carbonyl)oxolane-2-carboxylic acid
CID 102687423

Frequently Asked Questions

What is the IUPAC name of (2R,5S)-oxolane-2,5-dicarboxylic acid?
The IUPAC name of (2R,5S)-oxolane-2,5-dicarboxylic acid (CID 12667635) is (2R,5S)-oxolane-2,5-dicarboxylic acid.
What is the SMILES notation for (2R,5S)-oxolane-2,5-dicarboxylic acid?
The canonical SMILES for (2R,5S)-oxolane-2,5-dicarboxylic acid is O=C(O)[C@@H]1CC[C@H](C(=O)O)O1.
What is the InChIKey of (2R,5S)-oxolane-2,5-dicarboxylic acid?
The InChIKey is CWZQRDJXBMLSTF-ZXZARUISSA-N. The full InChI is InChI=1S/C6H8O5/c7-5(8)3-1-2-4(11-3)6(9)10/h3-4H,1-2H2,(H,7,8)(H,9,10)/t3-,4+.
What are the key properties of (2R,5S)-oxolane-2,5-dicarboxylic acid?
(2R,5S)-oxolane-2,5-dicarboxylic acid has a molecular weight of 160.12 g/mol, XLogP of -0.30, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5S)-oxolane-2,5-dicarboxylic acid is sourced from PubChem (CID 12667635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).