(3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol

C10H16O2 — CID 5319301

IUPAC(3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol
SMILESCC1=CCC2C(C)COC12CO
InChIInChI=1S/C10H16O2/c1-7-5-12-10(6-11)8(2)3-4-9(7)10/h3,7,9,11H,4-6H2,1-2H3
InChIKeyFRJFTZREOBRUSS-UHFFFAOYSA-N
MW168.24 g/mol
LogP1.35
Rot. Bonds1

About (3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol

(3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol (PubChem CID 5319301) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is (3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol.

Molecular Properties

Compound Name(3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol
PubChem CID5319301
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name(3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol
SMILESCC1=CCC2C(C)COC12CO
InChIInChI=1S/C10H16O2/c1-7-5-12-10(6-11)8(2)3-4-9(7)10/h3,7,9,11H,4-6H2,1-2H3
InChIKeyFRJFTZREOBRUSS-UHFFFAOYSA-N
XLogP1.35
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol 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

Jatamanin K
CID 46211184
[(1R,5R,7R)-4,7-dimethyl-6-oxabicyclo[3.2.1]oct-3-en-7-yl]methanol
CID 90476648
(3aS,4R,6aS)-6,6a-bis(hydroxymethyl)-2,3,3a,4-tetrahydrocyclopenta[b]furan-4-ol
CID 10797629
[6a-(Hydroxymethyl)-3-methylidene-3a,4-dihydrocyclopenta[b]furan-6-yl]methanol
CID 75149777
Eutypeterpene O
CID 170988912
(1r,5r,6Rs)-2,6-dimethyl-7-oxabicyclo[3.2.1]oct-2-en-6-ylmethanol
CID 129745098
(3aS,4S,6aS)-6,6a-bis(hydroxymethyl)-2,3,3a,4-tetrahydrocyclopenta[b]furan-4-ol
CID 154496464
(1s,5r,7r,s)-(4,7-Dimethyl-6-oxabicyclo[3.2.1]oct-3-en-7-yl)methanol
CID 86030936
(1s,5r,7s)-(4,7-Dimethyl-6-oxabicyclo[3.2.1]-oct-3-en-7-yl)methanol
CID 129751244
(1s,5r,7r)-(4,7-Dimethyl-6-oxabicyclo[3.2.1]-oct-3-en-7-yl)methanol
CID 129751777
(3S,4E)-4-ethylidene-3-propan-2-yloxolan-3-ol
CID 134952255
[(1R,5R,7S)-4,7-dimethyl-6-oxabicyclo[3.2.1]oct-3-en-7-yl]methanol
CID 101200836

Frequently Asked Questions

What is the IUPAC name of (3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol?
The IUPAC name of (3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol (CID 5319301) is (3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol.
What is the SMILES notation for (3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol?
The canonical SMILES for (3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol is CC1=CCC2C(C)COC12CO.
What is the InChIKey of (3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol?
The InChIKey is FRJFTZREOBRUSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2/c1-7-5-12-10(6-11)8(2)3-4-9(7)10/h3,7,9,11H,4-6H2,1-2H3.
What are the key properties of (3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol?
(3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol has a molecular weight of 168.24 g/mol, XLogP of 1.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,6-dimethyl-2,3,3a,4-tetrahydrocyclopenta[b]furan-6a-yl)methanol is sourced from PubChem (CID 5319301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).