2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine

C13H19NO3 — CID 117346859

IUPAC2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine
SMILESCOCc1cc(C2CNCCO2)ccc1OC
InChIInChI=1S/C13H19NO3/c1-15-9-11-7-10(3-4-12(11)16-2)13-8-14-5-6-17-13/h3-4,7,13-14H,5-6,8-9H2,1-2H3
InChIKeyIDQRWWLBQFEGND-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.50
Rot. Bonds4

About 2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine

2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine (PubChem CID 117346859) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is 2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine.

Molecular Properties

Compound Name2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine
PubChem CID117346859
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC Name2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine
SMILESCOCc1cc(C2CNCCO2)ccc1OC
InChIInChI=1S/C13H19NO3/c1-15-9-11-7-10(3-4-12(11)16-2)13-8-14-5-6-17-13/h3-4,7,13-14H,5-6,8-9H2,1-2H3
InChIKeyIDQRWWLBQFEGND-UHFFFAOYSA-N
XLogP1.50
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-cyclohexyl-4-methoxyphenyl)morpholine
CID 117440824
2-(3,4-dimethylphenyl)morpholine
CID 43169342
2-(4-phenylmethoxy-3-propylphenyl)morpholine
CID 69353396
2-(3-chloro-4-ethoxyphenyl)morpholine
CID 82293187
2-(3,5-dimethoxyphenyl)morpholine
CID 53414236
2-(1-methoxyisoquinolin-7-yl)morpholine
CID 117362678
2-[3-(1,2-dimethoxyethyl)phenyl]morpholine
CID 117381755
2-(2-fluoro-3,6-dimethoxyphenyl)morpholine
CID 84800876
2-(3-fluoro-5-methoxy-4-methylphenyl)morpholine
CID 117323473
2-(3-bromo-2,4-dimethoxyphenyl)morpholine
CID 117486500
3-methoxy-2-methyl-5-morpholin-2-ylphenol
CID 84789009
2-[3-chloro-4-(1-methylazetidin-3-yl)oxyphenyl]morpholine
CID 117454632

Frequently Asked Questions

What is the IUPAC name of 2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine?
The IUPAC name of 2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine (CID 117346859) is 2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine.
What is the SMILES notation for 2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine?
The canonical SMILES for 2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine is COCc1cc(C2CNCCO2)ccc1OC.
What is the InChIKey of 2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine?
The InChIKey is IDQRWWLBQFEGND-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-15-9-11-7-10(3-4-12(11)16-2)13-8-14-5-6-17-13/h3-4,7,13-14H,5-6,8-9H2,1-2H3.
What are the key properties of 2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine?
2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine has a molecular weight of 237.30 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine is sourced from PubChem (CID 117346859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).