(2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one

C11H20O2 — CID 71426371

IUPAC(2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one
SMILESCC(C)C1CC[C@](C)(CCO)C1=O
InChIInChI=1S/C11H20O2/c1-8(2)9-4-5-11(3,6-7-12)10(9)13/h8-9,12H,4-7H2,1-3H3/t9?,11-/m1/s1
InChIKeyGIWDFXCCOKCMCC-HCCKASOXSA-N
MW184.28 g/mol
LogP2.01
Rot. Bonds3

About (2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one

(2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one (PubChem CID 71426371) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is (2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one.

Molecular Properties

Compound Name(2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one
PubChem CID71426371
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name(2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one
SMILESCC(C)C1CC[C@](C)(CCO)C1=O
InChIInChI=1S/C11H20O2/c1-8(2)9-4-5-11(3,6-7-12)10(9)13/h8-9,12H,4-7H2,1-3H3/t9?,11-/m1/s1
InChIKeyGIWDFXCCOKCMCC-HCCKASOXSA-N
XLogP2.01
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one?
The IUPAC name of (2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one (CID 71426371) is (2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one.
What is the SMILES notation for (2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one?
The canonical SMILES for (2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one is CC(C)C1CC[C@](C)(CCO)C1=O.
What is the InChIKey of (2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one?
The InChIKey is GIWDFXCCOKCMCC-HCCKASOXSA-N. The full InChI is InChI=1S/C11H20O2/c1-8(2)9-4-5-11(3,6-7-12)10(9)13/h8-9,12H,4-7H2,1-3H3/t9?,11-/m1/s1.
What are the key properties of (2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one?
(2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one has a molecular weight of 184.28 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-hydroxyethyl)-2-methyl-5-propan-2-ylcyclopentan-1-one is sourced from PubChem (CID 71426371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).