2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol

C23H23NO — CID 69178546

IUPAC2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol
SMILESOCCc1ccc(-c2cccc(CC3Cc4ccccc4N3)c2)cc1
InChIInChI=1S/C23H23NO/c25-13-12-17-8-10-19(11-9-17)20-6-3-4-18(14-20)15-22-16-21-5-1-2-7-23(21)24-22/h1-11,14,22,24-25H,12-13,15-16H2
InChIKeyRBLMHAJUIMWSLC-UHFFFAOYSA-N
MW329.44 g/mol
LogP4.47
Rot. Bonds5

About 2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol

2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol (PubChem CID 69178546) has the molecular formula C23H23NO and a molecular weight of 329.44 g/mol. Its IUPAC name is 2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol.

Molecular Properties

Compound Name2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol
PubChem CID69178546
Molecular FormulaC23H23NO
Molecular Weight329.44 g/mol
Exact Mass329.18
IUPAC Name2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol
SMILESOCCc1ccc(-c2cccc(CC3Cc4ccccc4N3)c2)cc1
InChIInChI=1S/C23H23NO/c25-13-12-17-8-10-19(11-9-17)20-6-3-4-18(14-20)15-22-16-21-5-1-2-7-23(21)24-22/h1-11,14,22,24-25H,12-13,15-16H2
InChIKeyRBLMHAJUIMWSLC-UHFFFAOYSA-N
XLogP4.47
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol?
The IUPAC name of 2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol (CID 69178546) is 2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol.
What is the SMILES notation for 2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol?
The canonical SMILES for 2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol is OCCc1ccc(-c2cccc(CC3Cc4ccccc4N3)c2)cc1.
What is the InChIKey of 2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol?
The InChIKey is RBLMHAJUIMWSLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO/c25-13-12-17-8-10-19(11-9-17)20-6-3-4-18(14-20)15-22-16-21-5-1-2-7-23(21)24-22/h1-11,14,22,24-25H,12-13,15-16H2.
What are the key properties of 2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol?
2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol has a molecular weight of 329.44 g/mol, XLogP of 4.47, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[3-(2,3-dihydro-1H-indol-2-ylmethyl)phenyl]phenyl]ethanol is sourced from PubChem (CID 69178546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).