4-(2-phenylmethoxyethyl)morpholine

C13H19NO2 — CID 23215429

IUPAC4-(2-phenylmethoxyethyl)morpholine
SMILESc1ccc(COCCN2CCOCC2)cc1
InChIInChI=1S/C13H19NO2/c1-2-4-13(5-3-1)12-16-11-8-14-6-9-15-10-7-14/h1-5H,6-12H2
InChIKeyZFWRTOGKYLEMAB-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.54
Rot. Bonds5

About 4-(2-phenylmethoxyethyl)morpholine

4-(2-phenylmethoxyethyl)morpholine (PubChem CID 23215429) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 4-(2-phenylmethoxyethyl)morpholine.

Molecular Properties

Compound Name4-(2-phenylmethoxyethyl)morpholine
PubChem CID23215429
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name4-(2-phenylmethoxyethyl)morpholine
SMILESc1ccc(COCCN2CCOCC2)cc1
InChIInChI=1S/C13H19NO2/c1-2-4-13(5-3-1)12-16-11-8-14-6-9-15-10-7-14/h1-5H,6-12H2
InChIKeyZFWRTOGKYLEMAB-UHFFFAOYSA-N
XLogP1.54
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-(2-phenylmethoxyethyl)morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(2-phenylmethoxyethyl)morpholine?
The IUPAC name of 4-(2-phenylmethoxyethyl)morpholine (CID 23215429) is 4-(2-phenylmethoxyethyl)morpholine.
What is the SMILES notation for 4-(2-phenylmethoxyethyl)morpholine?
The canonical SMILES for 4-(2-phenylmethoxyethyl)morpholine is c1ccc(COCCN2CCOCC2)cc1.
What is the InChIKey of 4-(2-phenylmethoxyethyl)morpholine?
The InChIKey is ZFWRTOGKYLEMAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-2-4-13(5-3-1)12-16-11-8-14-6-9-15-10-7-14/h1-5H,6-12H2.
What are the key properties of 4-(2-phenylmethoxyethyl)morpholine?
4-(2-phenylmethoxyethyl)morpholine has a molecular weight of 221.30 g/mol, XLogP of 1.54, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenylmethoxyethyl)morpholine is sourced from PubChem (CID 23215429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).