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

C11H20O2 — CID 59012669

IUPAC2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-ol
SMILESCC1CC2C(O)(CC(C)C2(C)C)O1
InChIInChI=1S/C11H20O2/c1-7-6-11(12)9(10(7,3)4)5-8(2)13-11/h7-9,12H,5-6H2,1-4H3
InChIKeyMXMVOFBKGCKHLU-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.17
Rot. Bonds

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

2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-ol (PubChem CID 59012669) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-ol.

Molecular Properties

Compound Name2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-ol
PubChem CID59012669
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-ol
SMILESCC1CC2C(O)(CC(C)C2(C)C)O1
InChIInChI=1S/C11H20O2/c1-7-6-11(12)9(10(7,3)4)5-8(2)13-11/h7-9,12H,5-6H2,1-4H3
InChIKeyMXMVOFBKGCKHLU-UHFFFAOYSA-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 2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-ol with MolForge

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Launch Full Analysis

Related Compounds

(1S,4S,5R,8R,11R)-4,7,7,11-tetramethyl-6-oxatricyclo[6.3.0.01,5]undecan-5-ol
CID 163004116
(3aS,4S,6aR)-6a-methyl-4-propyl-1,3,3a,4,5,6-hexahydrocyclopenta[c]furan-3-ol
CID 134878043
(1S,4S,5S,8R,11R)-4,7,7,11-tetramethyl-6-oxatricyclo[6.3.0.01,5]undecan-5-ol
CID 101670394
10-Hydroxy-6,10-epoxy-7(14)-isodaucane
CID 91750030
(1R,4S,5S,8S,11S)-4,7,7,11-tetramethyl-6-oxatricyclo[6.3.0.01,5]undecan-5-ol
CID 91753728
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
(3R)-1-[(3aR,4R,6aS)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4-yl]-4,4-dimethyloctan-3-ol
CID 56617457
(3aR,4S,5R)-4-(hydroxymethyl)-5-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-2-ol
CID 58260975
(3aS,4R,5S,6aR)-4-ethyl-5-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-2-ol
CID 58620307
(3aR,4R,5S,6aR)-4-ethyl-5-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-2,3-diol
CID 58620309
4,4,5-Trimethyl-2,3,3a,5,6,6a-hexahydrocyclopenta[b]furan
CID 58645272

Frequently Asked Questions

What is the IUPAC name of 2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-ol?
The IUPAC name of 2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-ol (CID 59012669) is 2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-ol.
What is the SMILES notation for 2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-ol?
The canonical SMILES for 2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-ol is CC1CC2C(O)(CC(C)C2(C)C)O1.
What is the InChIKey of 2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-ol?
The InChIKey is MXMVOFBKGCKHLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-7-6-11(12)9(10(7,3)4)5-8(2)13-11/h7-9,12H,5-6H2,1-4H3.
What are the key properties of 2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-ol?
2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-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 2,4,4,5-tetramethyl-3,3a,5,6-tetrahydro-2H-cyclopenta[b]furan-6a-ol is sourced from PubChem (CID 59012669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).