3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol

C7H12O2 — CID 14148356

IUPAC3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol
SMILESOC1COC2CCCC12
InChIInChI=1S/C7H12O2/c8-6-4-9-7-3-1-2-5(6)7/h5-8H,1-4H2
InChIKeyYKVABCRYHKXRRJ-UHFFFAOYSA-N
MW128.17 g/mol
LogP0.55
Rot. Bonds

About 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol

3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol (PubChem CID 14148356) has the molecular formula C7H12O2 and a molecular weight of 128.17 g/mol. Its IUPAC name is 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol.

Molecular Properties

Compound Name3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol
PubChem CID14148356
Molecular FormulaC7H12O2
Molecular Weight128.17 g/mol
Exact Mass128.08
IUPAC Name3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol
SMILESOC1COC2CCCC12
InChIInChI=1S/C7H12O2/c8-6-4-9-7-3-1-2-5(6)7/h5-8H,1-4H2
InChIKeyYKVABCRYHKXRRJ-UHFFFAOYSA-N
XLogP0.55
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol 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

1-Oxaspiro[4.4]nonan-3-ol
CID 127263526
hexahydro-1H-cyclopenta[c]furan-3a-ol
CID 178199962
(3aS,4S,6aR)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4-ol
CID 10678252
(3S,3aR,6aR)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol
CID 21595351
(3R,3aR,6aR)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol
CID 21796761
(3aR,4R,6aS)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4-ol
CID 54186143
3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4-ol
CID 54186144
rel-(3aS,6S,6aR)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-6-ol
CID 58035449
3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3,6-diol
CID 58112352
(6aR)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4-ol
CID 70102550
(6aS)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4-ol
CID 70102931
(3R,3aS,6aR)-3-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan
CID 89392956

Frequently Asked Questions

What is the IUPAC name of 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol?
The IUPAC name of 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol (CID 14148356) is 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol.
What is the SMILES notation for 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol?
The canonical SMILES for 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol is OC1COC2CCCC12.
What is the InChIKey of 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol?
The InChIKey is YKVABCRYHKXRRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O2/c8-6-4-9-7-3-1-2-5(6)7/h5-8H,1-4H2.
What are the key properties of 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol?
3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol has a molecular weight of 128.17 g/mol, XLogP of 0.55, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-3-ol is sourced from PubChem (CID 14148356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).