1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol

C19H18O — CID 142825914

IUPAC1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol
SMILESC=C1Cc2ccc(O)cc2C12CC(C)c1ccccc12
InChIInChI=1S/C19H18O/c1-12-11-19(17-6-4-3-5-16(12)17)13(2)9-14-7-8-15(20)10-18(14)19/h3-8,10,12,20H,2,9,11H2,1H3
InChIKeyFEXKPPJKEQKAFY-UHFFFAOYSA-N
MW262.35 g/mol
LogP4.30
Rot. Bonds

About 1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol

1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol (PubChem CID 142825914) has the molecular formula C19H18O and a molecular weight of 262.35 g/mol. Its IUPAC name is 1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol.

Molecular Properties

Compound Name1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol
PubChem CID142825914
Molecular FormulaC19H18O
Molecular Weight262.35 g/mol
Exact Mass262.14
IUPAC Name1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol
SMILESC=C1Cc2ccc(O)cc2C12CC(C)c1ccccc12
InChIInChI=1S/C19H18O/c1-12-11-19(17-6-4-3-5-16(12)17)13(2)9-14-7-8-15(20)10-18(14)19/h3-8,10,12,20H,2,9,11H2,1H3
InChIKeyFEXKPPJKEQKAFY-UHFFFAOYSA-N
XLogP4.30
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol?
The IUPAC name of 1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol (CID 142825914) is 1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol.
What is the SMILES notation for 1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol?
The canonical SMILES for 1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol is C=C1Cc2ccc(O)cc2C12CC(C)c1ccccc12.
What is the InChIKey of 1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol?
The InChIKey is FEXKPPJKEQKAFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18O/c1-12-11-19(17-6-4-3-5-16(12)17)13(2)9-14-7-8-15(20)10-18(14)19/h3-8,10,12,20H,2,9,11H2,1H3.
What are the key properties of 1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol?
1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol has a molecular weight of 262.35 g/mol, XLogP of 4.30, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2'-methylidenespiro[1,2-dihydroindene-3,3'-1H-indene]-5'-ol is sourced from PubChem (CID 142825914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).