4-(2-Phenoxyethyl)morpholine

C12H17NO2 — CID 2840999

IUPAC4-(2-phenoxyethyl)morpholine
SMILESC1COCCN1CCOC2=CC=CC=C2
InChIInChI=1S/C12H17NO2/c1-2-4-12(5-3-1)15-11-8-13-6-9-14-10-7-13/h1-5H,6-11H2
InChIKeyFDMDXNDAQKLGBA-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.60
Rot. Bonds4

About 4-(2-Phenoxyethyl)morpholine

4-(2-Phenoxyethyl)morpholine (PubChem CID 2840999) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 4-(2-phenoxyethyl)morpholine.

Molecular Properties

Compound Name4-(2-Phenoxyethyl)morpholine
PubChem CID2840999
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name4-(2-phenoxyethyl)morpholine
SMILESC1COCCN1CCOC2=CC=CC=C2
InChIInChI=1S/C12H17NO2/c1-2-4-12(5-3-1)15-11-8-13-6-9-14-10-7-13/h1-5H,6-11H2
InChIKeyFDMDXNDAQKLGBA-UHFFFAOYSA-N
XLogP1.60
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity163

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-Phenoxyethyl)morpholine?
The IUPAC name of 4-(2-Phenoxyethyl)morpholine (CID 2840999) is 4-(2-phenoxyethyl)morpholine.
What is the SMILES notation for 4-(2-Phenoxyethyl)morpholine?
The canonical SMILES for 4-(2-Phenoxyethyl)morpholine is C1COCCN1CCOC2=CC=CC=C2.
What is the InChIKey of 4-(2-Phenoxyethyl)morpholine?
The InChIKey is FDMDXNDAQKLGBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-2-4-12(5-3-1)15-11-8-13-6-9-14-10-7-13/h1-5H,6-11H2.
What are the key properties of 4-(2-Phenoxyethyl)morpholine?
4-(2-Phenoxyethyl)morpholine has a molecular weight of 207.27 g/mol, XLogP of 1.60, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-Phenoxyethyl)morpholine is sourced from PubChem (CID 2840999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).