methanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol

C13H18O2 — CID 143977527

IUPACmethanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol
SMILESCC1CC12CCc1ccc(O)cc12.CO
InChIInChI=1S/C12H14O.CH4O/c1-8-7-12(8)5-4-9-2-3-10(13)6-11(9)12;1-2/h2-3,6,8,13H,4-5,7H2,1H3;2H,1H3
InChIKeyQRWWPIHMWHQIMS-UHFFFAOYSA-N
MW206.28 g/mol
LogP2.22
Rot. Bonds

About methanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol

methanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol (PubChem CID 143977527) has the molecular formula C13H18O2 and a molecular weight of 206.28 g/mol. Its IUPAC name is methanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol.

Molecular Properties

Compound Namemethanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol
PubChem CID143977527
Molecular FormulaC13H18O2
Molecular Weight206.28 g/mol
Exact Mass206.13
IUPAC Namemethanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol
SMILESCC1CC12CCc1ccc(O)cc12.CO
InChIInChI=1S/C12H14O.CH4O/c1-8-7-12(8)5-4-9-2-3-10(13)6-11(9)12;1-2/h2-3,6,8,13H,4-5,7H2,1H3;2H,1H3
InChIKeyQRWWPIHMWHQIMS-UHFFFAOYSA-N
XLogP2.22
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2'R,3R)-2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol
CID 89082538
(2'S,5R)-2'-methylspiro[6,7,8,9-tetrahydrobenzo[7]annulene-5,1'-cyclopropane]-3-ol
CID 58380254
(2'S,3R)-2'-methylspiro[1,2-dihydroindene-3,1'-cyclobutane]-5-ol
CID 143977501
methyl (1'R,3R)-5-hydroxyspiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-carboxylate
CID 58379700
ethyl (1'R,3R)-5-hydroxyspiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-carboxylate
CID 58379899
(1'S,3S)-5-hydroxyspiro[1,2-dihydroindene-3,2'-cyclobutane]-1'-carbonitrile
CID 58379907
methyl (1'S,3R)-5-hydroxyspiro[1,2-dihydroindene-3,2'-cyclobutane]-1'-carboxylate
CID 58379866
3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol
CID 84717952
3,3-diamino-1,2-dihydroinden-5-ol
CID 66833532
methyl (1'S,5R)-3-hydroxyspiro[6,7,8,9-tetrahydrobenzo[7]annulene-5,2'-cyclopropane]-1'-carboxylate
CID 143977595
1,3,3-trimethyl-1,2-dihydroinden-5-ol
CID 18183555
1,1-dimethyl-3,4-dihydro-2H-isoquinolin-7-ol
CID 84717936

Frequently Asked Questions

What is the IUPAC name of methanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol?
The IUPAC name of methanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol (CID 143977527) is methanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol.
What is the SMILES notation for methanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol?
The canonical SMILES for methanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol is CC1CC12CCc1ccc(O)cc12.CO.
What is the InChIKey of methanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol?
The InChIKey is QRWWPIHMWHQIMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O.CH4O/c1-8-7-12(8)5-4-9-2-3-10(13)6-11(9)12;1-2/h2-3,6,8,13H,4-5,7H2,1H3;2H,1H3.
What are the key properties of methanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol?
methanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol has a molecular weight of 206.28 g/mol, XLogP of 2.22, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol is sourced from PubChem (CID 143977527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).