2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol

C15H23NO3 — CID 61049972

IUPAC2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol
SMILESCCOc1ccccc1C(CO)NCC1CCCO1
InChIInChI=1S/C15H23NO3/c1-2-18-15-8-4-3-7-13(15)14(11-17)16-10-12-6-5-9-19-12/h3-4,7-8,12,14,16-17H,2,5-6,9-11H2,1H3
InChIKeyITXHIKVDYXAUND-UHFFFAOYSA-N
MW265.35 g/mol
LogP1.89
Rot. Bonds7

About 2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol

2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol (PubChem CID 61049972) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol.

Molecular Properties

Compound Name2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol
PubChem CID61049972
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol
SMILESCCOc1ccccc1C(CO)NCC1CCCO1
InChIInChI=1S/C15H23NO3/c1-2-18-15-8-4-3-7-13(15)14(11-17)16-10-12-6-5-9-19-12/h3-4,7-8,12,14,16-17H,2,5-6,9-11H2,1H3
InChIKeyITXHIKVDYXAUND-UHFFFAOYSA-N
XLogP1.89
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-(oxolan-2-yl)-1-(2-propoxyphenyl)ethanamine
CID 104659878
2-(2,5-difluorophenyl)-2-(oxolan-2-ylmethylamino)ethanol
CID 61048778
1-[2-(oxolan-2-ylmethoxy)phenyl]-N-propylpropan-1-amine
CID 43279172
2-(oxolan-2-ylmethylamino)-2-(4-propan-2-ylphenyl)ethanol
CID 61050569
2-(4-methoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol
CID 61050567
[2-(oxolan-2-yl)-1-(2-propoxyphenyl)ethyl]hydrazine
CID 105198546
(1S)-1-[2-(oxolan-2-ylmethoxy)phenyl]propan-1-amine
CID 78932149
N-ethyl-1-(2-methoxyphenyl)-3-(oxolan-2-yl)propan-1-amine
CID 65166709
1-(2-ethoxyphenyl)-3-(oxolan-2-ylmethyl)urea
CID 47195849
1-[2-(oxolan-2-ylmethoxy)phenyl]propan-1-ol
CID 43503555
2-(oxolan-2-ylmethylamino)-2-(4-propan-2-yloxyphenyl)ethanol
CID 61049777
1-[2-(oxan-2-ylmethoxy)phenyl]-N-propylpropan-1-amine
CID 43591765

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol?
The IUPAC name of 2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol (CID 61049972) is 2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol.
What is the SMILES notation for 2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol?
The canonical SMILES for 2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol is CCOc1ccccc1C(CO)NCC1CCCO1.
What is the InChIKey of 2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol?
The InChIKey is ITXHIKVDYXAUND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-2-18-15-8-4-3-7-13(15)14(11-17)16-10-12-6-5-9-19-12/h3-4,7-8,12,14,16-17H,2,5-6,9-11H2,1H3.
What are the key properties of 2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol?
2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol has a molecular weight of 265.35 g/mol, XLogP of 1.89, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyphenyl)-2-(oxolan-2-ylmethylamino)ethanol is sourced from PubChem (CID 61049972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).