[3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol

C15H23NO4 — CID 43174640

IUPAC[3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol
SMILESCCOc1cccc(CO)c1OCCN1CCOCC1
InChIInChI=1S/C15H23NO4/c1-2-19-14-5-3-4-13(12-17)15(14)20-11-8-16-6-9-18-10-7-16/h3-5,17H,2,6-12H2,1H3
InChIKeyBPUHQLBQZZZQGG-UHFFFAOYSA-N
MW281.35 g/mol
LogP1.29
Rot. Bonds7

About [3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol

[3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol (PubChem CID 43174640) has the molecular formula C15H23NO4 and a molecular weight of 281.35 g/mol. Its IUPAC name is [3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol.

Molecular Properties

Compound Name[3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol
PubChem CID43174640
Molecular FormulaC15H23NO4
Molecular Weight281.35 g/mol
Exact Mass281.16
IUPAC Name[3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol
SMILESCCOc1cccc(CO)c1OCCN1CCOCC1
InChIInChI=1S/C15H23NO4/c1-2-19-14-5-3-4-13(12-17)15(14)20-11-8-16-6-9-18-10-7-16/h3-5,17H,2,6-12H2,1H3
InChIKeyBPUHQLBQZZZQGG-UHFFFAOYSA-N
XLogP1.29
TPSA51.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.35
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol?
The IUPAC name of [3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol (CID 43174640) is [3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol.
What is the SMILES notation for [3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol?
The canonical SMILES for [3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol is CCOc1cccc(CO)c1OCCN1CCOCC1.
What is the InChIKey of [3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol?
The InChIKey is BPUHQLBQZZZQGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO4/c1-2-19-14-5-3-4-13(12-17)15(14)20-11-8-16-6-9-18-10-7-16/h3-5,17H,2,6-12H2,1H3.
What are the key properties of [3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol?
[3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol has a molecular weight of 281.35 g/mol, XLogP of 1.29, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-ethoxy-2-(2-morpholin-4-ylethoxy)phenyl]methanol is sourced from PubChem (CID 43174640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).