6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan

C8H14O — CID 14039398

IUPAC6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan
SMILESCC1CCC2CCOC12
InChIInChI=1S/C8H14O/c1-6-2-3-7-4-5-9-8(6)7/h6-8H,2-5H2,1H3
InChIKeyGRWZBVYKSPGIBI-UHFFFAOYSA-N
MW126.20 g/mol
LogP1.82
Rot. Bonds

About 6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan

6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan (PubChem CID 14039398) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is 6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan.

Molecular Properties

Compound Name6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan
PubChem CID14039398
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan
SMILESCC1CCC2CCOC12
InChIInChI=1S/C8H14O/c1-6-2-3-7-4-5-9-8(6)7/h6-8H,2-5H2,1H3
InChIKeyGRWZBVYKSPGIBI-UHFFFAOYSA-N
XLogP1.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan with MolForge

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Related Compounds

Oxabicyclo(3,3,0)octan
CID 14039396
trans-2-Oxabicyclo[3.3.0]octane
CID 21595350
2-ethyl-6,6,6a-trimethyl-3,3a,4,5-tetrahydro-2H-cyclopenta[b]furan
CID 68733861
3,6,6a-Trimethyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan
CID 135040130
(3aR,6aR)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan
CID 14039397
3-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan
CID 14039400
3,6-dimethyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan
CID 14039402
(3aR,6aR)-3,6-dimethyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan
CID 14039403
3-butyl-4,4,6a-trimethyl-3,3a,5,6-tetrahydro-1H-cyclopenta[c]furan
CID 20437269
4,4,6a-trimethyl-3-propyl-3,3a,5,6-tetrahydro-1H-cyclopenta[c]furan
CID 20437270
3-butan-2-yl-4,4,6a-trimethyl-3,3a,5,6-tetrahydro-1H-cyclopenta[c]furan
CID 20437272
4,4,5,6a-tetramethyl-3-propyl-3,3a,5,6-tetrahydro-1H-cyclopenta[c]furan
CID 20437273

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan?
The IUPAC name of 6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan (CID 14039398) is 6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan.
What is the SMILES notation for 6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan?
The canonical SMILES for 6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan is CC1CCC2CCOC12.
What is the InChIKey of 6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan?
The InChIKey is GRWZBVYKSPGIBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O/c1-6-2-3-7-4-5-9-8(6)7/h6-8H,2-5H2,1H3.
What are the key properties of 6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan?
6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan has a molecular weight of 126.20 g/mol, XLogP of 1.82, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan is sourced from PubChem (CID 14039398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).