2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one

C11H16O2 — CID 102577240

IUPAC2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one
SMILESO=C1CCC=C1[C@H](O)C1CCCC1
InChIInChI=1S/C11H16O2/c12-10-7-3-6-9(10)11(13)8-4-1-2-5-8/h6,8,11,13H,1-5,7H2/t11-/m1/s1
InChIKeyIUSYYRPLXPFKNK-LLVKDONJSA-N
MW180.25 g/mol
LogP1.83
Rot. Bonds2

About 2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one

2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one (PubChem CID 102577240) has the molecular formula C11H16O2 and a molecular weight of 180.25 g/mol. Its IUPAC name is 2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one.

Molecular Properties

Compound Name2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one
PubChem CID102577240
Molecular FormulaC11H16O2
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one
SMILESO=C1CCC=C1[C@H](O)C1CCCC1
InChIInChI=1S/C11H16O2/c12-10-7-3-6-9(10)11(13)8-4-1-2-5-8/h6,8,11,13H,1-5,7H2/t11-/m1/s1
InChIKeyIUSYYRPLXPFKNK-LLVKDONJSA-N
XLogP1.83
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one?
The IUPAC name of 2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one (CID 102577240) is 2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one.
What is the SMILES notation for 2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one?
The canonical SMILES for 2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one is O=C1CCC=C1[C@H](O)C1CCCC1.
What is the InChIKey of 2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one?
The InChIKey is IUSYYRPLXPFKNK-LLVKDONJSA-N. The full InChI is InChI=1S/C11H16O2/c12-10-7-3-6-9(10)11(13)8-4-1-2-5-8/h6,8,11,13H,1-5,7H2/t11-/m1/s1.
What are the key properties of 2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one?
2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one has a molecular weight of 180.25 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(R)-cyclopentyl(hydroxy)methyl]cyclopent-2-en-1-one is sourced from PubChem (CID 102577240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).