(4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one

C10H10O2 — CID 164574449

IUPAC(4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one
SMILESCC1=CC(=O)C[C@H]1c1ccoc1
InChIInChI=1S/C10H10O2/c1-7-4-9(11)5-10(7)8-2-3-12-6-8/h2-4,6,10H,5H2,1H3/t10-/m1/s1
InChIKeyNNAHPZMXBYDAIX-SNVBAGLBSA-N
MW162.19 g/mol
LogP2.28
Rot. Bonds1

About (4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one

(4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one (PubChem CID 164574449) has the molecular formula C10H10O2 and a molecular weight of 162.19 g/mol. Its IUPAC name is (4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one.

Molecular Properties

Compound Name(4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one
PubChem CID164574449
Molecular FormulaC10H10O2
Molecular Weight162.19 g/mol
Exact Mass162.07
IUPAC Name(4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one
SMILESCC1=CC(=O)C[C@H]1c1ccoc1
InChIInChI=1S/C10H10O2/c1-7-4-9(11)5-10(7)8-2-3-12-6-8/h2-4,6,10H,5H2,1H3/t10-/m1/s1
InChIKeyNNAHPZMXBYDAIX-SNVBAGLBSA-N
XLogP2.28
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one?
The IUPAC name of (4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one (CID 164574449) is (4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one.
What is the SMILES notation for (4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one?
The canonical SMILES for (4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one is CC1=CC(=O)C[C@H]1c1ccoc1.
What is the InChIKey of (4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one?
The InChIKey is NNAHPZMXBYDAIX-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H10O2/c1-7-4-9(11)5-10(7)8-2-3-12-6-8/h2-4,6,10H,5H2,1H3/t10-/m1/s1.
What are the key properties of (4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one?
(4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one has a molecular weight of 162.19 g/mol, XLogP of 2.28, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(furan-3-yl)-3-methylcyclopent-2-en-1-one is sourced from PubChem (CID 164574449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).