ethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol

C16H24O — CID 144506413

IUPACethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol
SMILESCC.Cc1ccc(O)c2c1CC1(CCCC1)C2
InChIInChI=1S/C14H18O.C2H6/c1-10-4-5-13(15)12-9-14(8-11(10)12)6-2-3-7-14;1-2/h4-5,15H,2-3,6-9H2,1H3;1-2H3
InChIKeyUKQNDBVQXGHEKY-UHFFFAOYSA-N
MW232.37 g/mol
LogP4.39
Rot. Bonds

About ethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol

ethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol (PubChem CID 144506413) has the molecular formula C16H24O and a molecular weight of 232.37 g/mol. Its IUPAC name is ethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol.

Molecular Properties

Compound Nameethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol
PubChem CID144506413
Molecular FormulaC16H24O
Molecular Weight232.37 g/mol
Exact Mass232.18
IUPAC Nameethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol
SMILESCC.Cc1ccc(O)c2c1CC1(CCCC1)C2
InChIInChI=1S/C14H18O.C2H6/c1-10-4-5-13(15)12-9-14(8-11(10)12)6-2-3-7-14;1-2/h4-5,15H,2-3,6-9H2,1H3;1-2H3
InChIKeyUKQNDBVQXGHEKY-UHFFFAOYSA-N
XLogP4.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol?
The IUPAC name of ethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol (CID 144506413) is ethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol.
What is the SMILES notation for ethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol?
The canonical SMILES for ethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol is CC.Cc1ccc(O)c2c1CC1(CCCC1)C2.
What is the InChIKey of ethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol?
The InChIKey is UKQNDBVQXGHEKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O.C2H6/c1-10-4-5-13(15)12-9-14(8-11(10)12)6-2-3-7-14;1-2/h4-5,15H,2-3,6-9H2,1H3;1-2H3.
What are the key properties of ethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol?
ethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol has a molecular weight of 232.37 g/mol, XLogP of 4.39, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;7-methylspiro[1,3-dihydroindene-2,1'-cyclopentane]-4-ol is sourced from PubChem (CID 144506413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).