2-(5-fluoro-2,3-dimethoxyphenyl)morpholine

C12H16FNO3 — CID 117354893

IUPAC2-(5-fluoro-2,3-dimethoxyphenyl)morpholine
SMILESCOc1cc(F)cc(C2CNCCO2)c1OC
InChIInChI=1S/C12H16FNO3/c1-15-10-6-8(13)5-9(12(10)16-2)11-7-14-3-4-17-11/h5-6,11,14H,3-4,7H2,1-2H3
InChIKeyPGCZREVXWGVPCN-UHFFFAOYSA-N
MW241.26 g/mol
LogP1.50
Rot. Bonds3

About 2-(5-fluoro-2,3-dimethoxyphenyl)morpholine

2-(5-fluoro-2,3-dimethoxyphenyl)morpholine (PubChem CID 117354893) has the molecular formula C12H16FNO3 and a molecular weight of 241.26 g/mol. Its IUPAC name is 2-(5-fluoro-2,3-dimethoxyphenyl)morpholine.

Molecular Properties

Compound Name2-(5-fluoro-2,3-dimethoxyphenyl)morpholine
PubChem CID117354893
Molecular FormulaC12H16FNO3
Molecular Weight241.26 g/mol
Exact Mass241.11
IUPAC Name2-(5-fluoro-2,3-dimethoxyphenyl)morpholine
SMILESCOc1cc(F)cc(C2CNCCO2)c1OC
InChIInChI=1S/C12H16FNO3/c1-15-10-6-8(13)5-9(12(10)16-2)11-7-14-3-4-17-11/h5-6,11,14H,3-4,7H2,1-2H3
InChIKeyPGCZREVXWGVPCN-UHFFFAOYSA-N
XLogP1.50
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.26
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-fluoro-2,3-dimethoxy-4-methylsulfanylphenyl)morpholine
CID 117463646
2-[5-(difluoromethyl)-3-fluoro-2-methoxyphenyl]morpholine
CID 117406688
2-(3-chloro-4,5-dimethoxy-2-propan-2-ylphenyl)morpholine
CID 117482760
2-(2,4-dimethoxy-5-methylphenyl)morpholine
CID 117346886
2-(2-chloro-4,5-dimethoxyphenyl)morpholine
CID 117397861
2-(2-fluoro-3,6-dimethoxyphenyl)morpholine
CID 84800876
2-(3-chloro-2-methoxy-4,5-dimethylphenyl)morpholine
CID 115004570
2-[2-(difluoromethyl)-4,5-dimethoxyphenyl]morpholine
CID 117435420
2-(6-chloro-2,3,4-trimethoxyphenyl)morpholine
CID 117464374
2-(3-bromo-2-methoxy-5-methylphenyl)morpholine
CID 115004626
2-(3-bromo-2,4-dimethoxyphenyl)morpholine
CID 117486500
4-bromo-2-fluoro-3-methoxy-6-morpholin-2-ylphenol
CID 117491089

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2,3-dimethoxyphenyl)morpholine?
The IUPAC name of 2-(5-fluoro-2,3-dimethoxyphenyl)morpholine (CID 117354893) is 2-(5-fluoro-2,3-dimethoxyphenyl)morpholine.
What is the SMILES notation for 2-(5-fluoro-2,3-dimethoxyphenyl)morpholine?
The canonical SMILES for 2-(5-fluoro-2,3-dimethoxyphenyl)morpholine is COc1cc(F)cc(C2CNCCO2)c1OC.
What is the InChIKey of 2-(5-fluoro-2,3-dimethoxyphenyl)morpholine?
The InChIKey is PGCZREVXWGVPCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO3/c1-15-10-6-8(13)5-9(12(10)16-2)11-7-14-3-4-17-11/h5-6,11,14H,3-4,7H2,1-2H3.
What are the key properties of 2-(5-fluoro-2,3-dimethoxyphenyl)morpholine?
2-(5-fluoro-2,3-dimethoxyphenyl)morpholine has a molecular weight of 241.26 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2,3-dimethoxyphenyl)morpholine is sourced from PubChem (CID 117354893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).