(3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol

C11H20O2 — CID 13047879

IUPAC(3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol
SMILESCC1(C)C[C@@H]2C(O)OC(C)(C)[C@@H]2C1
InChIInChI=1S/C11H20O2/c1-10(2)5-7-8(6-10)11(3,4)13-9(7)12/h7-9,12H,5-6H2,1-4H3/t7-,8+,9?/m0/s1
InChIKeyUMICAFAEJJVJCY-ZQTLJVIJSA-N
MW184.28 g/mol
LogP2.17
Rot. Bonds

About (3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol

(3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol (PubChem CID 13047879) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is (3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol.

Molecular Properties

Compound Name(3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol
PubChem CID13047879
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name(3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol
SMILESCC1(C)C[C@@H]2C(O)OC(C)(C)[C@@H]2C1
InChIInChI=1S/C11H20O2/c1-10(2)5-7-8(6-10)11(3,4)13-9(7)12/h7-9,12H,5-6H2,1-4H3/t7-,8+,9?/m0/s1
InChIKeyUMICAFAEJJVJCY-ZQTLJVIJSA-N
XLogP2.17
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-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

(1S,3aS,4aR,8aR,8bS)-4a,8,8,8a-tetramethyl-1,3,3a,4,5,6,7,8b-octahydroindeno[1,2-c]furan-1-ol
CID 14527126
(+)-14,15-Epoxy-thapsan-14-ol
CID 11379426
2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-ol
CID 59012669
(3aS,4S,6aR)-6a-methyl-4-propyl-1,3,3a,4,5,6-hexahydrocyclopenta[c]furan-3-ol
CID 134878043
(1R,3aS,4aS,8aS,8bS)-4a,8,8,8a-tetramethyl-1,3,3a,4,5,6,7,8b-octahydroindeno[1,2-c]furan-1-ol
CID 135020352
3-Methoxy-1,1,3,4,4-pentamethyl-3a,5,6,6a-tetrahydrocyclopenta[c]furan
CID 21632300
4a,8,8,8a-Tetramethyl-1,3,3a,4,5,6,7,8b-octahydroindeno[1,2-c]furan-1-ol
CID 14527125
4-(3-hydroxy-3-methyloctyl)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-2-ol
CID 21328891
4-[3-(2,3-dimethylbutan-2-yl)octyl]-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-2-ol
CID 21328906
Actinium;6-(2,4-diethyl-1-methylcyclopentyl)-1-(1,3-dioxolan-2-yl)hexan-3-ol
CID 23399638
1-(2,4-Diethylcyclopentyl)-3-(1,3-dioxolan-2-yl)propan-1-ol
CID 23560888
Actinium;1-(2,4-diethylcyclopentyl)-3-(1,3-dioxolan-2-yl)propan-1-ol
CID 23560889

Frequently Asked Questions

What is the IUPAC name of (3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol?
The IUPAC name of (3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol (CID 13047879) is (3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol.
What is the SMILES notation for (3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol?
The canonical SMILES for (3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol is CC1(C)C[C@@H]2C(O)OC(C)(C)[C@@H]2C1.
What is the InChIKey of (3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol?
The InChIKey is UMICAFAEJJVJCY-ZQTLJVIJSA-N. The full InChI is InChI=1S/C11H20O2/c1-10(2)5-7-8(6-10)11(3,4)13-9(7)12/h7-9,12H,5-6H2,1-4H3/t7-,8+,9?/m0/s1.
What are the key properties of (3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol?
(3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol has a molecular weight of 184.28 g/mol, XLogP of 2.17, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3aR,6aS)-3,3,5,5-tetramethyl-3a,4,6,6a-tetrahydro-1H-cyclopenta[c]furan-1-ol is sourced from PubChem (CID 13047879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).