2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride

C13H20ClNO3 — CID 90230019

IUPAC2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride
SMILESCl.OCCc1ccc(OCC2CNCCO2)cc1
InChIInChI=1S/C13H19NO3.ClH/c15-7-5-11-1-3-12(4-2-11)17-10-13-9-14-6-8-16-13;/h1-4,13-15H,5-10H2;1H
InChIKeyUYYDGUWIYGERMB-UHFFFAOYSA-N
MW273.76 g/mol
LogP1.01
Rot. Bonds5

About 2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride

2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride (PubChem CID 90230019) has the molecular formula C13H20ClNO3 and a molecular weight of 273.76 g/mol. Its IUPAC name is 2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride.

Molecular Properties

Compound Name2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride
PubChem CID90230019
Molecular FormulaC13H20ClNO3
Molecular Weight273.76 g/mol
Exact Mass273.11
IUPAC Name2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride
SMILESCl.OCCc1ccc(OCC2CNCCO2)cc1
InChIInChI=1S/C13H19NO3.ClH/c15-7-5-11-1-3-12(4-2-11)17-10-13-9-14-6-8-16-13;/h1-4,13-15H,5-10H2;1H
InChIKeyUYYDGUWIYGERMB-UHFFFAOYSA-N
XLogP1.01
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.76
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride?
The IUPAC name of 2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride (CID 90230019) is 2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride.
What is the SMILES notation for 2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride?
The canonical SMILES for 2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride is Cl.OCCc1ccc(OCC2CNCCO2)cc1.
What is the InChIKey of 2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride?
The InChIKey is UYYDGUWIYGERMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3.ClH/c15-7-5-11-1-3-12(4-2-11)17-10-13-9-14-6-8-16-13;/h1-4,13-15H,5-10H2;1H.
What are the key properties of 2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride?
2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride has a molecular weight of 273.76 g/mol, XLogP of 1.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(morpholin-2-ylmethoxy)phenyl]ethanol;hydrochloride is sourced from PubChem (CID 90230019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).