2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol

C14H25NO2 — CID 173236383

IUPAC2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol
SMILESCCN(CC)CCOC1=CCCC=C1CCO
InChIInChI=1S/C14H25NO2/c1-3-15(4-2)10-12-17-14-8-6-5-7-13(14)9-11-16/h7-8,16H,3-6,9-12H2,1-2H3
InChIKeyVINIMEVMEALAHG-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.33
Rot. Bonds8

About 2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol

2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol (PubChem CID 173236383) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol.

Molecular Properties

Compound Name2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol
PubChem CID173236383
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol
SMILESCCN(CC)CCOC1=CCCC=C1CCO
InChIInChI=1S/C14H25NO2/c1-3-15(4-2)10-12-17-14-8-6-5-7-13(14)9-11-16/h7-8,16H,3-6,9-12H2,1-2H3
InChIKeyVINIMEVMEALAHG-UHFFFAOYSA-N
XLogP2.33
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol?
The IUPAC name of 2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol (CID 173236383) is 2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol.
What is the SMILES notation for 2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol?
The canonical SMILES for 2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol is CCN(CC)CCOC1=CCCC=C1CCO.
What is the InChIKey of 2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol?
The InChIKey is VINIMEVMEALAHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-3-15(4-2)10-12-17-14-8-6-5-7-13(14)9-11-16/h7-8,16H,3-6,9-12H2,1-2H3.
What are the key properties of 2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol?
2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol has a molecular weight of 239.36 g/mol, XLogP of 2.33, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[2-(diethylamino)ethoxy]cyclohexa-1,5-dien-1-yl]ethanol is sourced from PubChem (CID 173236383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).