(2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol

C6H10O3 — CID 121320949

IUPAC(2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol
SMILESOC[C@H]1C=C[C@@H](O)C1O
InChIInChI=1S/C6H10O3/c7-3-4-1-2-5(8)6(4)9/h1-2,4-9H,3H2/t4-,5-,6?/m1/s1
InChIKeyMIKATYFDVCPCSB-QYRBDRAASA-N
MW130.14 g/mol
LogP-1.11
Rot. Bonds1

About (2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol

(2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol (PubChem CID 121320949) has the molecular formula C6H10O3 and a molecular weight of 130.14 g/mol. Its IUPAC name is (2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol.

Molecular Properties

Compound Name(2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol
PubChem CID121320949
Molecular FormulaC6H10O3
Molecular Weight130.14 g/mol
Exact Mass130.06
IUPAC Name(2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol
SMILESOC[C@H]1C=C[C@@H](O)C1O
InChIInChI=1S/C6H10O3/c7-3-4-1-2-5(8)6(4)9/h1-2,4-9H,3H2/t4-,5-,6?/m1/s1
InChIKeyMIKATYFDVCPCSB-QYRBDRAASA-N
XLogP-1.11
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.14
LogP ≤ 5-1.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol?
The IUPAC name of (2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol (CID 121320949) is (2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol.
What is the SMILES notation for (2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol?
The canonical SMILES for (2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol is OC[C@H]1C=C[C@@H](O)C1O.
What is the InChIKey of (2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol?
The InChIKey is MIKATYFDVCPCSB-QYRBDRAASA-N. The full InChI is InChI=1S/C6H10O3/c7-3-4-1-2-5(8)6(4)9/h1-2,4-9H,3H2/t4-,5-,6?/m1/s1.
What are the key properties of (2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol?
(2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol has a molecular weight of 130.14 g/mol, XLogP of -1.11, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5R)-5-(hydroxymethyl)cyclopent-3-ene-1,2-diol is sourced from PubChem (CID 121320949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).