6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine

C14H19ClFNO2 — CID 102856484

IUPAC6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine
SMILESCC1(C)CNCC(COCc2cccc(Cl)c2F)O1
InChIInChI=1S/C14H19ClFNO2/c1-14(2)9-17-6-11(19-14)8-18-7-10-4-3-5-12(15)13(10)16/h3-5,11,17H,6-9H2,1-2H3
InChIKeyCUGPGQYHAUEZSO-UHFFFAOYSA-N
MW287.76 g/mol
LogP2.76
Rot. Bonds4

About 6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine

6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine (PubChem CID 102856484) has the molecular formula C14H19ClFNO2 and a molecular weight of 287.76 g/mol. Its IUPAC name is 6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine.

Molecular Properties

Compound Name6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine
PubChem CID102856484
Molecular FormulaC14H19ClFNO2
Molecular Weight287.76 g/mol
Exact Mass287.11
IUPAC Name6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine
SMILESCC1(C)CNCC(COCc2cccc(Cl)c2F)O1
InChIInChI=1S/C14H19ClFNO2/c1-14(2)9-17-6-11(19-14)8-18-7-10-4-3-5-12(15)13(10)16/h3-5,11,17H,6-9H2,1-2H3
InChIKeyCUGPGQYHAUEZSO-UHFFFAOYSA-N
XLogP2.76
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.76
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine 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-dimethyl-6-[(2-nitrophenyl)methoxymethyl]morpholine
CID 114775521
6-[(2-methoxy-3-pyridinyl)methoxymethyl]-2,2-dimethylmorpholine
CID 114775440
6-[(3-methoxyphenyl)methoxymethyl]-2,2-dimethylmorpholine
CID 114775645
2,2-dimethyl-6-[(5-methyl-1,2-oxazol-3-yl)methoxymethyl]morpholine
CID 114775307
N-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide
CID 114775297
4-[(3-chloro-2-fluorophenyl)methoxy]piperidine
CID 103695215
2,2-dimethyl-6-[(3-propan-2-ylimidazol-4-yl)methoxymethyl]morpholine
CID 106939028
2-fluoro-3-(morpholin-2-ylmethoxymethyl)benzonitrile
CID 107118745
4-[(6,6-dimethylmorpholin-2-yl)methoxy]benzonitrile
CID 114775943
6-[(4-chloro-1,3-thiazol-2-yl)oxymethyl]-2,2-dimethylmorpholine
CID 114775902
2,2-dimethyl-6-(oxolan-3-ylmethoxymethyl)morpholine
CID 114775329
1-[(3-chloro-2-fluorophenyl)methyl]-2,5,5-trimethylpiperazine
CID 102862477

Frequently Asked Questions

What is the IUPAC name of 6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine?
The IUPAC name of 6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine (CID 102856484) is 6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine.
What is the SMILES notation for 6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine?
The canonical SMILES for 6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine is CC1(C)CNCC(COCc2cccc(Cl)c2F)O1.
What is the InChIKey of 6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine?
The InChIKey is CUGPGQYHAUEZSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClFNO2/c1-14(2)9-17-6-11(19-14)8-18-7-10-4-3-5-12(15)13(10)16/h3-5,11,17H,6-9H2,1-2H3.
What are the key properties of 6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine?
6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine has a molecular weight of 287.76 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine is sourced from PubChem (CID 102856484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).