(1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol

C17H18O2 — CID 55183055

IUPAC(1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol
SMILESC[C@@H](O)c1ccccc1Oc1ccc2c(c1)CCC2
InChIInChI=1S/C17H18O2/c1-12(18)16-7-2-3-8-17(16)19-15-10-9-13-5-4-6-14(13)11-15/h2-3,7-12,18H,4-6H2,1H3/t12-/m1/s1
InChIKeyYHYYBGZUPRYYCW-GFCCVEGCSA-N
MW254.33 g/mol
LogP4.02
Rot. Bonds3

About (1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol

(1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol (PubChem CID 55183055) has the molecular formula C17H18O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is (1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol
PubChem CID55183055
Molecular FormulaC17H18O2
Molecular Weight254.33 g/mol
Exact Mass254.13
IUPAC Name(1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol
SMILESC[C@@H](O)c1ccccc1Oc1ccc2c(c1)CCC2
InChIInChI=1S/C17H18O2/c1-12(18)16-7-2-3-8-17(16)19-15-10-9-13-5-4-6-14(13)11-15/h2-3,7-12,18H,4-6H2,1H3/t12-/m1/s1
InChIKeyYHYYBGZUPRYYCW-GFCCVEGCSA-N
XLogP4.02
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol?
The IUPAC name of (1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol (CID 55183055) is (1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol.
What is the SMILES notation for (1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol?
The canonical SMILES for (1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol is C[C@@H](O)c1ccccc1Oc1ccc2c(c1)CCC2.
What is the InChIKey of (1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol?
The InChIKey is YHYYBGZUPRYYCW-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H18O2/c1-12(18)16-7-2-3-8-17(16)19-15-10-9-13-5-4-6-14(13)11-15/h2-3,7-12,18H,4-6H2,1H3/t12-/m1/s1.
What are the key properties of (1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol?
(1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol has a molecular weight of 254.33 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]ethanol is sourced from PubChem (CID 55183055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).