6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan

C10H16O — CID 58645264

IUPAC6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan
SMILESCC1(C)C=CC2CCOC21C
InChIInChI=1S/C10H16O/c1-9(2)6-4-8-5-7-11-10(8,9)3/h4,6,8H,5,7H2,1-3H3
InChIKeyVFLNMNUHMDXNQM-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.38
Rot. Bonds

About 6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan

6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan (PubChem CID 58645264) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan.

Molecular Properties

Compound Name6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan
PubChem CID58645264
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan
SMILESCC1(C)C=CC2CCOC21C
InChIInChI=1S/C10H16O/c1-9(2)6-4-8-5-7-11-10(8,9)3/h4,6,8H,5,7H2,1-3H3
InChIKeyVFLNMNUHMDXNQM-UHFFFAOYSA-N
XLogP2.38
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(3aR,4S,7aR)-4,7a-dimethyl-3,3a,4,7-tetrahydro-2H-1-benzofuran
CID 102394792
(3aR,4S,7aR)-4-ethyl-7a-methyl-3,3a,4,7-tetrahydro-2H-1-benzofuran
CID 102394793
(3aR,4R,7aR)-4-ethyl-7a-methyl-3,3a,4,7-tetrahydro-2H-1-benzofuran
CID 102394794
1-(Butoxymethyl)bicyclo[2.2.1]hept-2-ene
CID 133053504
(2R,3R)-2-tert-butyl-3-[(1E)-2-methylbuta-1,3-dienyl]oxolane
CID 134969003
(5S)-2,6,6,10-tetramethyl-1-oxaspiro[4.5]dec-8-ene
CID 137300531
2,2,4-Trimethyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)tetrahydrofuran
CID 22914101
2,2-Dimethyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)tetrahydrofuran
CID 22914105
3-(2,2,3-Trimethylcyclopent-3-en-1-yl)oxolane
CID 22914152
9,9-Di(propan-2-yl)-3-oxabicyclo[4.2.1]non-7-ene
CID 58353552
3,4-dimethyl-2-[(E)-pent-2-enyl]oxolane
CID 59018701
(3aR)-1,3,3,7a-tetramethyl-3a-propan-2-yl-4,7-dihydro-1H-2-benzofuran
CID 69585743

Frequently Asked Questions

What is the IUPAC name of 6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan?
The IUPAC name of 6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan (CID 58645264) is 6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan.
What is the SMILES notation for 6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan?
The canonical SMILES for 6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan is CC1(C)C=CC2CCOC21C.
What is the InChIKey of 6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan?
The InChIKey is VFLNMNUHMDXNQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-9(2)6-4-8-5-7-11-10(8,9)3/h4,6,8H,5,7H2,1-3H3.
What are the key properties of 6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan?
6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan has a molecular weight of 152.24 g/mol, XLogP of 2.38, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6,6a-trimethyl-3,3a-dihydro-2H-cyclopenta[b]furan is sourced from PubChem (CID 58645264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).