2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol

C24H30O2 — CID 102025626

IUPAC2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol
SMILESOCCC1(C2(CCO)CCCc3ccccc32)CCCc2ccccc21
InChIInChI=1S/C24H30O2/c25-17-15-23(13-5-9-19-7-1-3-11-21(19)23)24(16-18-26)14-6-10-20-8-2-4-12-22(20)24/h1-4,7-8,11-12,25-26H,5-6,9-10,13-18H2
InChIKeyCQEOAPJTEMCDHE-UHFFFAOYSA-N
MW350.50 g/mol
LogP4.30
Rot. Bonds5

About 2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol

2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol (PubChem CID 102025626) has the molecular formula C24H30O2 and a molecular weight of 350.50 g/mol. Its IUPAC name is 2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol.

Molecular Properties

Compound Name2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol
PubChem CID102025626
Molecular FormulaC24H30O2
Molecular Weight350.50 g/mol
Exact Mass350.22
IUPAC Name2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol
SMILESOCCC1(C2(CCO)CCCc3ccccc32)CCCc2ccccc21
InChIInChI=1S/C24H30O2/c25-17-15-23(13-5-9-19-7-1-3-11-21(19)23)24(16-18-26)14-6-10-20-8-2-4-12-22(20)24/h1-4,7-8,11-12,25-26H,5-6,9-10,13-18H2
InChIKeyCQEOAPJTEMCDHE-UHFFFAOYSA-N
XLogP4.30
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.50
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol?
The IUPAC name of 2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol (CID 102025626) is 2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol.
What is the SMILES notation for 2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol?
The canonical SMILES for 2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol is OCCC1(C2(CCO)CCCc3ccccc32)CCCc2ccccc21.
What is the InChIKey of 2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol?
The InChIKey is CQEOAPJTEMCDHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30O2/c25-17-15-23(13-5-9-19-7-1-3-11-21(19)23)24(16-18-26)14-6-10-20-8-2-4-12-22(20)24/h1-4,7-8,11-12,25-26H,5-6,9-10,13-18H2.
What are the key properties of 2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol?
2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol has a molecular weight of 350.50 g/mol, XLogP of 4.30, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[1-(2-hydroxyethyl)-3,4-dihydro-2H-naphthalen-1-yl]-3,4-dihydro-2H-naphthalen-1-yl]ethanol is sourced from PubChem (CID 102025626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).