2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol

C14H20ClNO3 — CID 111432795

IUPAC2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol
SMILESOCCOCCN1CCOC(c2ccccc2Cl)C1
InChIInChI=1S/C14H20ClNO3/c15-13-4-2-1-3-12(13)14-11-16(6-9-19-14)5-8-18-10-7-17/h1-4,14,17H,5-11H2
InChIKeyMUBAKQPVQQFXHP-UHFFFAOYSA-N
MW285.77 g/mol
LogP1.72
Rot. Bonds6

About 2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol

2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol (PubChem CID 111432795) has the molecular formula C14H20ClNO3 and a molecular weight of 285.77 g/mol. Its IUPAC name is 2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol
PubChem CID111432795
Molecular FormulaC14H20ClNO3
Molecular Weight285.77 g/mol
Exact Mass285.11
IUPAC Name2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol
SMILESOCCOCCN1CCOC(c2ccccc2Cl)C1
InChIInChI=1S/C14H20ClNO3/c15-13-4-2-1-3-12(13)14-11-16(6-9-19-14)5-8-18-10-7-17/h1-4,14,17H,5-11H2
InChIKeyMUBAKQPVQQFXHP-UHFFFAOYSA-N
XLogP1.72
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.77
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol?
The IUPAC name of 2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol (CID 111432795) is 2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol?
The canonical SMILES for 2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol is OCCOCCN1CCOC(c2ccccc2Cl)C1.
What is the InChIKey of 2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol?
The InChIKey is MUBAKQPVQQFXHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClNO3/c15-13-4-2-1-3-12(13)14-11-16(6-9-19-14)5-8-18-10-7-17/h1-4,14,17H,5-11H2.
What are the key properties of 2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol?
2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol has a molecular weight of 285.77 g/mol, XLogP of 1.72, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-chlorophenyl)morpholin-4-yl]ethoxy]ethanol is sourced from PubChem (CID 111432795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).