1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol

C17H22O2 — CID 102646424

IUPAC1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
SMILESCC(O)(C1=CCCCO1)c1ccc2c(c1)CCCC2
InChIInChI=1S/C17H22O2/c1-17(18,16-8-4-5-11-19-16)15-10-9-13-6-2-3-7-14(13)12-15/h8-10,12,18H,2-7,11H2,1H3
InChIKeyQIFFDRVBCYXJEA-UHFFFAOYSA-N
MW258.36 g/mol
LogP3.47
Rot. Bonds2

About 1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol

1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol (PubChem CID 102646424) has the molecular formula C17H22O2 and a molecular weight of 258.36 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
PubChem CID102646424
Molecular FormulaC17H22O2
Molecular Weight258.36 g/mol
Exact Mass258.16
IUPAC Name1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
SMILESCC(O)(C1=CCCCO1)c1ccc2c(c1)CCCC2
InChIInChI=1S/C17H22O2/c1-17(18,16-8-4-5-11-19-16)15-10-9-13-6-2-3-7-14(13)12-15/h8-10,12,18H,2-7,11H2,1H3
InChIKeyQIFFDRVBCYXJEA-UHFFFAOYSA-N
XLogP3.47
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol?
The IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol (CID 102646424) is 1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol?
The canonical SMILES for 1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol is CC(O)(C1=CCCCO1)c1ccc2c(c1)CCCC2.
What is the InChIKey of 1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol?
The InChIKey is QIFFDRVBCYXJEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22O2/c1-17(18,16-8-4-5-11-19-16)15-10-9-13-6-2-3-7-14(13)12-15/h8-10,12,18H,2-7,11H2,1H3.
What are the key properties of 1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol?
1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol has a molecular weight of 258.36 g/mol, XLogP of 3.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-pyran-6-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol is sourced from PubChem (CID 102646424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).