2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol

C17H22O — CID 79558173

IUPAC2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol
SMILESOC1(CC2CC3CCC2C3)Cc2ccccc2C1
InChIInChI=1S/C17H22O/c18-17(9-14-3-1-2-4-15(14)10-17)11-16-8-12-5-6-13(16)7-12/h1-4,12-13,16,18H,5-11H2
InChIKeyGSJHVEHSNHEJMV-UHFFFAOYSA-N
MW242.36 g/mol
LogP3.34
Rot. Bonds2

About 2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol

2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol (PubChem CID 79558173) has the molecular formula C17H22O and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol.

Molecular Properties

Compound Name2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol
PubChem CID79558173
Molecular FormulaC17H22O
Molecular Weight242.36 g/mol
Exact Mass242.17
IUPAC Name2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol
SMILESOC1(CC2CC3CCC2C3)Cc2ccccc2C1
InChIInChI=1S/C17H22O/c18-17(9-14-3-1-2-4-15(14)10-17)11-16-8-12-5-6-13(16)7-12/h1-4,12-13,16,18H,5-11H2
InChIKeyGSJHVEHSNHEJMV-UHFFFAOYSA-N
XLogP3.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol with MolForge

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Related Compounds

2-(2-bicyclo[2.2.1]heptanylmethyl)-3,4-dihydro-1H-naphthalene-2-carboxylic acid
CID 79558584
2-(2-deuterio-2-phenylethyl)bicyclo[2.2.1]heptane
CID 101152696
3-(2-bicyclo[2.2.1]heptanylmethyl)-3-(2-chlorophenyl)azetidine
CID 79550928
1-(2-bicyclo[2.2.1]heptanylmethyl)-3,4-dimethylcyclohexan-1-ol
CID 79559177
2-(2-bicyclo[2.2.1]heptanylmethyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79559488
N-(2-bicyclo[2.2.1]heptanylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 63682089
1-(2-bicyclo[2.2.1]heptanyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-2-ol
CID 115778375
2-(2-bicyclo[2.2.1]heptanyl)-1-(1-phenylcyclobutyl)ethanone
CID 79561425
1-(2-bicyclo[2.2.1]heptanyl)-3-phenylbutan-2-ol
CID 79557822
3-(2-bicyclo[2.2.1]heptanylmethyl)-3-(4-fluorophenyl)azetidine
CID 79550569
(1S,2R,4R)-2-[(E)-3-phenylprop-2-enyl]bicyclo[2.2.1]heptane
CID 71507650
1-(2-bicyclo[2.2.1]heptanyl)-3-naphthalen-1-ylpropan-2-ol
CID 63519467

Frequently Asked Questions

What is the IUPAC name of 2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol?
The IUPAC name of 2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol (CID 79558173) is 2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol.
What is the SMILES notation for 2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol?
The canonical SMILES for 2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol is OC1(CC2CC3CCC2C3)Cc2ccccc2C1.
What is the InChIKey of 2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol?
The InChIKey is GSJHVEHSNHEJMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22O/c18-17(9-14-3-1-2-4-15(14)10-17)11-16-8-12-5-6-13(16)7-12/h1-4,12-13,16,18H,5-11H2.
What are the key properties of 2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol?
2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol has a molecular weight of 242.36 g/mol, XLogP of 3.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-dihydroinden-2-ol is sourced from PubChem (CID 79558173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).