6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan

C10H16O — CID 141083514

IUPAC6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan
SMILESC=CCC12CCCC1CCO2
InChIInChI=1S/C10H16O/c1-2-6-10-7-3-4-9(10)5-8-11-10/h2,9H,1,3-8H2
InChIKeyRKCINQOHUJNPPU-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.52
Rot. Bonds2

About 6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan

6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan (PubChem CID 141083514) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan.

Molecular Properties

Compound Name6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan
PubChem CID141083514
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan
SMILESC=CCC12CCCC1CCO2
InChIInChI=1S/C10H16O/c1-2-6-10-7-3-4-9(10)5-8-11-10/h2,9H,1,3-8H2
InChIKeyRKCINQOHUJNPPU-UHFFFAOYSA-N
XLogP2.52
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.52
H-Bond Donors ≤ 50
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 6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan?
The IUPAC name of 6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan (CID 141083514) is 6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan.
What is the SMILES notation for 6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan?
The canonical SMILES for 6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan is C=CCC12CCCC1CCO2.
What is the InChIKey of 6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan?
The InChIKey is RKCINQOHUJNPPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-2-6-10-7-3-4-9(10)5-8-11-10/h2,9H,1,3-8H2.
What are the key properties of 6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan?
6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan has a molecular weight of 152.24 g/mol, XLogP of 2.52, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6a-prop-2-enyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan is sourced from PubChem (CID 141083514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).