(6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one

C10H14O2 — CID 102305467

IUPAC(6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one
SMILESC[C@@H]1CCC2=C1C(=O)OC2(C)C
InChIInChI=1S/C10H14O2/c1-6-4-5-7-8(6)9(11)12-10(7,2)3/h6H,4-5H2,1-3H3/t6-/m1/s1
InChIKeyWVQKDYVEYQYWKK-ZCFIWIBFSA-N
MW166.22 g/mol
LogP2.05
Rot. Bonds

About (6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one

(6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one (PubChem CID 102305467) has the molecular formula C10H14O2 and a molecular weight of 166.22 g/mol. Its IUPAC name is (6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one.

Molecular Properties

Compound Name(6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one
PubChem CID102305467
Molecular FormulaC10H14O2
Molecular Weight166.22 g/mol
Exact Mass166.10
IUPAC Name(6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one
SMILESC[C@@H]1CCC2=C1C(=O)OC2(C)C
InChIInChI=1S/C10H14O2/c1-6-4-5-7-8(6)9(11)12-10(7,2)3/h6H,4-5H2,1-3H3/t6-/m1/s1
InChIKeyWVQKDYVEYQYWKK-ZCFIWIBFSA-N
XLogP2.05
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one?
The IUPAC name of (6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one (CID 102305467) is (6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one.
What is the SMILES notation for (6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one?
The canonical SMILES for (6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one is C[C@@H]1CCC2=C1C(=O)OC2(C)C.
What is the InChIKey of (6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one?
The InChIKey is WVQKDYVEYQYWKK-ZCFIWIBFSA-N. The full InChI is InChI=1S/C10H14O2/c1-6-4-5-7-8(6)9(11)12-10(7,2)3/h6H,4-5H2,1-3H3/t6-/m1/s1.
What are the key properties of (6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one?
(6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one has a molecular weight of 166.22 g/mol, XLogP of 2.05, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-3,3,6-trimethyl-5,6-dihydro-4H-cyclopenta[c]furan-1-one is sourced from PubChem (CID 102305467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).