(5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol

C15H20O2 — CID 114229925

IUPAC(5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol
SMILESCOc1ccc2c(c1)C1(CC2)C(CO)C1(C)C
InChIInChI=1S/C15H20O2/c1-14(2)13(9-16)15(14)7-6-10-4-5-11(17-3)8-12(10)15/h4-5,8,13,16H,6-7,9H2,1-3H3
InChIKeyWUMFOIMDOXGJTG-UHFFFAOYSA-N
MW232.32 g/mol
LogP2.53
Rot. Bonds2

About (5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol

(5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol (PubChem CID 114229925) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is (5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol.

Molecular Properties

Compound Name(5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol
PubChem CID114229925
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Name(5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol
SMILESCOc1ccc2c(c1)C1(CC2)C(CO)C1(C)C
InChIInChI=1S/C15H20O2/c1-14(2)13(9-16)15(14)7-6-10-4-5-11(17-3)8-12(10)15/h4-5,8,13,16H,6-7,9H2,1-3H3
InChIKeyWUMFOIMDOXGJTG-UHFFFAOYSA-N
XLogP2.53
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol?
The IUPAC name of (5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol (CID 114229925) is (5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol.
What is the SMILES notation for (5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol?
The canonical SMILES for (5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol is COc1ccc2c(c1)C1(CC2)C(CO)C1(C)C.
What is the InChIKey of (5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol?
The InChIKey is WUMFOIMDOXGJTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O2/c1-14(2)13(9-16)15(14)7-6-10-4-5-11(17-3)8-12(10)15/h4-5,8,13,16H,6-7,9H2,1-3H3.
What are the key properties of (5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol?
(5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol has a molecular weight of 232.32 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxy-2',2'-dimethylspiro[1,2-dihydroindene-3,3'-cyclopropane]-1'-yl)methanol is sourced from PubChem (CID 114229925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).