ethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate

C14H18FNO3 — CID 46210073

IUPACethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate
SMILESCCOC(=O)C(c1ccc(F)cc1)N1CCOCC1
InChIInChI=1S/C14H18FNO3/c1-2-19-14(17)13(16-7-9-18-10-8-16)11-3-5-12(15)6-4-11/h3-6,13H,2,7-10H2,1H3
InChIKeyJGWVTKWCSCVAKX-UHFFFAOYSA-N
MW267.30 g/mol
LogP1.76
Rot. Bonds4

About ethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate

ethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate (PubChem CID 46210073) has the molecular formula C14H18FNO3 and a molecular weight of 267.30 g/mol. Its IUPAC name is ethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate.

Molecular Properties

Compound Nameethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate
PubChem CID46210073
Molecular FormulaC14H18FNO3
Molecular Weight267.30 g/mol
Exact Mass267.13
IUPAC Nameethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate
SMILESCCOC(=O)C(c1ccc(F)cc1)N1CCOCC1
InChIInChI=1S/C14H18FNO3/c1-2-19-14(17)13(16-7-9-18-10-8-16)11-3-5-12(15)6-4-11/h3-6,13H,2,7-10H2,1H3
InChIKeyJGWVTKWCSCVAKX-UHFFFAOYSA-N
XLogP1.76
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.30
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze ethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate 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 ethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate?
The IUPAC name of ethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate (CID 46210073) is ethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate.
What is the SMILES notation for ethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate?
The canonical SMILES for ethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate is CCOC(=O)C(c1ccc(F)cc1)N1CCOCC1.
What is the InChIKey of ethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate?
The InChIKey is JGWVTKWCSCVAKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO3/c1-2-19-14(17)13(16-7-9-18-10-8-16)11-3-5-12(15)6-4-11/h3-6,13H,2,7-10H2,1H3.
What are the key properties of ethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate?
ethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate has a molecular weight of 267.30 g/mol, XLogP of 1.76, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(4-fluorophenyl)-2-morpholin-4-ylacetate is sourced from PubChem (CID 46210073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).