2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine

C13H18FNO2 — CID 117350776

IUPAC2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine
SMILESCOc1cccc(C2CNCCO2)c1C(C)F
InChIInChI=1S/C13H18FNO2/c1-9(14)13-10(4-3-5-11(13)16-2)12-8-15-6-7-17-12/h3-5,9,12,15H,6-8H2,1-2H3
InChIKeyQKYIAMGDGQWVDB-UHFFFAOYSA-N
MW239.29 g/mol
LogP2.39
Rot. Bonds3

About 2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine

2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine (PubChem CID 117350776) has the molecular formula C13H18FNO2 and a molecular weight of 239.29 g/mol. Its IUPAC name is 2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine.

Molecular Properties

Compound Name2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine
PubChem CID117350776
Molecular FormulaC13H18FNO2
Molecular Weight239.29 g/mol
Exact Mass239.13
IUPAC Name2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine
SMILESCOc1cccc(C2CNCCO2)c1C(C)F
InChIInChI=1S/C13H18FNO2/c1-9(14)13-10(4-3-5-11(13)16-2)12-8-15-6-7-17-12/h3-5,9,12,15H,6-8H2,1-2H3
InChIKeyQKYIAMGDGQWVDB-UHFFFAOYSA-N
XLogP2.39
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.29
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine with MolForge

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

Launch Full Analysis

Related Compounds

2-[2-(1-fluoroethyl)-4,5-dimethoxyphenyl]morpholine
CID 117426455
3-[2-(1-fluoroethyl)-3-methoxyphenyl]piperidine
CID 84700227
2-[2-(difluoromethyl)-4,5-dimethoxyphenyl]morpholine
CID 117435420
2-(2-methoxy-4-methylphenyl)morpholine
CID 82611084
2-(2-chloro-4,5-dimethoxyphenyl)morpholine
CID 117397861
2-(2-fluoro-3,6-dimethoxyphenyl)morpholine
CID 84800876
2-(3-bromo-2,4-dimethoxyphenyl)morpholine
CID 117486500
2-(3-chloro-4,5-dimethoxy-2-propan-2-ylphenyl)morpholine
CID 117482760
2-(7-methoxy-2-methyl-1-benzofuran-4-yl)morpholine
CID 82622926
2-[2-(difluoromethyl)-5-methoxyphenyl]morpholine
CID 117359395
2-(7-methoxy-1H-indol-4-yl)morpholine
CID 115004261
2-(2,4-dimethoxy-5-methylphenyl)morpholine
CID 117346886

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine?
The IUPAC name of 2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine (CID 117350776) is 2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine.
What is the SMILES notation for 2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine?
The canonical SMILES for 2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine is COc1cccc(C2CNCCO2)c1C(C)F.
What is the InChIKey of 2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine?
The InChIKey is QKYIAMGDGQWVDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FNO2/c1-9(14)13-10(4-3-5-11(13)16-2)12-8-15-6-7-17-12/h3-5,9,12,15H,6-8H2,1-2H3.
What are the key properties of 2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine?
2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine has a molecular weight of 239.29 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine is sourced from PubChem (CID 117350776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).