(3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol

C8H14O2 — CID 10855569

IUPAC(3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol
SMILESC[C@]12CCC[C@H]1CC(O)O2
InChIInChI=1S/C8H14O2/c1-8-4-2-3-6(8)5-7(9)10-8/h6-7,9H,2-5H2,1H3/t6-,7?,8-/m0/s1
InChIKeyRIPWVJZMTMSLFJ-PPSBICQBSA-N
MW142.20 g/mol
LogP1.28
Rot. Bonds

About (3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol

(3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol (PubChem CID 10855569) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is (3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol.

Molecular Properties

Compound Name(3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol
PubChem CID10855569
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name(3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol
SMILESC[C@]12CCC[C@H]1CC(O)O2
InChIInChI=1S/C8H14O2/c1-8-4-2-3-6(8)5-7(9)10-8/h6-7,9H,2-5H2,1H3/t6-,7?,8-/m0/s1
InChIKeyRIPWVJZMTMSLFJ-PPSBICQBSA-N
XLogP1.28
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol?
The IUPAC name of (3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol (CID 10855569) is (3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol.
What is the SMILES notation for (3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol?
The canonical SMILES for (3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol is C[C@]12CCC[C@H]1CC(O)O2.
What is the InChIKey of (3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol?
The InChIKey is RIPWVJZMTMSLFJ-PPSBICQBSA-N. The full InChI is InChI=1S/C8H14O2/c1-8-4-2-3-6(8)5-7(9)10-8/h6-7,9H,2-5H2,1H3/t6-,7?,8-/m0/s1.
What are the key properties of (3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol?
(3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol has a molecular weight of 142.20 g/mol, XLogP of 1.28, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3aS,6aS)-6a-methyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan-2-ol is sourced from PubChem (CID 10855569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).