(1S)-cyclopent-2-en-1-ol

C5H8O — CID 11789128

IUPAC(1S)-cyclopent-2-en-1-ol
SMILESO[C@@H]1C=CCC1
InChIInChI=1S/C5H8O/c6-5-3-1-2-4-5/h1,3,5-6H,2,4H2/t5-/m1/s1
InChIKeyPSBABBDEUFNFKJ-RXMQYKEDSA-N
MW84.12 g/mol
LogP0.70
Rot. Bonds

About (1S)-cyclopent-2-en-1-ol

(1S)-cyclopent-2-en-1-ol (PubChem CID 11789128) has the molecular formula C5H8O and a molecular weight of 84.12 g/mol. Its IUPAC name is (1S)-cyclopent-2-en-1-ol.

Molecular Properties

Compound Name(1S)-cyclopent-2-en-1-ol
PubChem CID11789128
Molecular FormulaC5H8O
Molecular Weight84.12 g/mol
Exact Mass84.06
IUPAC Name(1S)-cyclopent-2-en-1-ol
SMILESO[C@@H]1C=CCC1
InChIInChI=1S/C5H8O/c6-5-3-1-2-4-5/h1,3,5-6H,2,4H2/t5-/m1/s1
InChIKeyPSBABBDEUFNFKJ-RXMQYKEDSA-N
XLogP0.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50084.12
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 (1S)-cyclopent-2-en-1-ol?
The IUPAC name of (1S)-cyclopent-2-en-1-ol (CID 11789128) is (1S)-cyclopent-2-en-1-ol.
What is the SMILES notation for (1S)-cyclopent-2-en-1-ol?
The canonical SMILES for (1S)-cyclopent-2-en-1-ol is O[C@@H]1C=CCC1.
What is the InChIKey of (1S)-cyclopent-2-en-1-ol?
The InChIKey is PSBABBDEUFNFKJ-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H8O/c6-5-3-1-2-4-5/h1,3,5-6H,2,4H2/t5-/m1/s1.
What are the key properties of (1S)-cyclopent-2-en-1-ol?
(1S)-cyclopent-2-en-1-ol has a molecular weight of 84.12 g/mol, XLogP of 0.70, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-cyclopent-2-en-1-ol is sourced from PubChem (CID 11789128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).