(5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one

C15H18O2 — CID 10489648

IUPAC(5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one
SMILESCC1=CC2=C(C)C3(CC3)[C@@](C)(O)C(=O)C2=C1C
InChIInChI=1S/C15H18O2/c1-8-7-11-10(3)15(5-6-15)14(4,17)13(16)12(11)9(8)2/h7,17H,5-6H2,1-4H3/t14-/m0/s1
InChIKeyVDIMPSNBSLTOMR-AWEZNQCLSA-N
MW230.31 g/mol
LogP2.69
Rot. Bonds

About (5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one

(5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one (PubChem CID 10489648) has the molecular formula C15H18O2 and a molecular weight of 230.31 g/mol. Its IUPAC name is (5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one.

Molecular Properties

Compound Name(5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one
PubChem CID10489648
Molecular FormulaC15H18O2
Molecular Weight230.31 g/mol
Exact Mass230.13
IUPAC Name(5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one
SMILESCC1=CC2=C(C)C3(CC3)[C@@](C)(O)C(=O)C2=C1C
InChIInChI=1S/C15H18O2/c1-8-7-11-10(3)15(5-6-15)14(4,17)13(16)12(11)9(8)2/h7,17H,5-6H2,1-4H3/t14-/m0/s1
InChIKeyVDIMPSNBSLTOMR-AWEZNQCLSA-N
XLogP2.69
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one?
The IUPAC name of (5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one (CID 10489648) is (5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one.
What is the SMILES notation for (5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one?
The canonical SMILES for (5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one is CC1=CC2=C(C)C3(CC3)[C@@](C)(O)C(=O)C2=C1C.
What is the InChIKey of (5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one?
The InChIKey is VDIMPSNBSLTOMR-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H18O2/c1-8-7-11-10(3)15(5-6-15)14(4,17)13(16)12(11)9(8)2/h7,17H,5-6H2,1-4H3/t14-/m0/s1.
What are the key properties of (5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one?
(5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one has a molecular weight of 230.31 g/mol, XLogP of 2.69, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5'R)-5'-hydroxy-2',3',5',7'-tetramethylspiro[cyclopropane-1,6'-indene]-4'-one is sourced from PubChem (CID 10489648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).