5-(2,5-dimethoxyphenyl)-2-methylmorpholine

C13H19NO3 — CID 82291906

IUPAC5-(2,5-dimethoxyphenyl)-2-methylmorpholine
SMILESCOc1ccc(OC)c(C2COC(C)CN2)c1
InChIInChI=1S/C13H19NO3/c1-9-7-14-12(8-17-9)11-6-10(15-2)4-5-13(11)16-3/h4-6,9,12,14H,7-8H2,1-3H3
InChIKeyHDQKMMGAODUXCP-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.75
Rot. Bonds3

About 5-(2,5-dimethoxyphenyl)-2-methylmorpholine

5-(2,5-dimethoxyphenyl)-2-methylmorpholine (PubChem CID 82291906) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is 5-(2,5-dimethoxyphenyl)-2-methylmorpholine.

Molecular Properties

Compound Name5-(2,5-dimethoxyphenyl)-2-methylmorpholine
PubChem CID82291906
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC Name5-(2,5-dimethoxyphenyl)-2-methylmorpholine
SMILESCOc1ccc(OC)c(C2COC(C)CN2)c1
InChIInChI=1S/C13H19NO3/c1-9-7-14-12(8-17-9)11-6-10(15-2)4-5-13(11)16-3/h4-6,9,12,14H,7-8H2,1-3H3
InChIKeyHDQKMMGAODUXCP-UHFFFAOYSA-N
XLogP1.75
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,5-dimethoxyphenyl)azetidine
CID 55295985
5-(4-methoxy-3-propan-2-ylphenyl)-2-methylmorpholine
CID 82297024
(4R)-4-(2,5-dimethoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride
CID 171184283
2-(5-bromo-2-methoxyphenyl)aziridine
CID 82473824
3-(2,5-dimethoxyphenyl)-7-methyl-1,4-thiazepane 1-oxide
CID 66224688
2-methyl-5-[4-[(2-methylpropan-2-yl)oxy]phenyl]morpholine
CID 82297057
4-(5-chloro-2-methoxyphenyl)-1,3-oxazolidine
CID 175424496
3-(2,4-dimethoxyphenyl)-6-methyl-1,4-thiazepane
CID 66226613
2-(2,5-dimethoxyphenyl)-4,7-dimethyl-2,3-dihydro-1H-indole
CID 3436838
4-(2,5-dimethoxyphenyl)pyrrolidine-3-carboxylic acid
CID 63938447
(2R,5R)-5-(4-fluorophenyl)-2-methylmorpholine
CID 66996015
2-(2,5-dimethoxyphenyl)oxan-3-amine
CID 79364595

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dimethoxyphenyl)-2-methylmorpholine?
The IUPAC name of 5-(2,5-dimethoxyphenyl)-2-methylmorpholine (CID 82291906) is 5-(2,5-dimethoxyphenyl)-2-methylmorpholine.
What is the SMILES notation for 5-(2,5-dimethoxyphenyl)-2-methylmorpholine?
The canonical SMILES for 5-(2,5-dimethoxyphenyl)-2-methylmorpholine is COc1ccc(OC)c(C2COC(C)CN2)c1.
What is the InChIKey of 5-(2,5-dimethoxyphenyl)-2-methylmorpholine?
The InChIKey is HDQKMMGAODUXCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-9-7-14-12(8-17-9)11-6-10(15-2)4-5-13(11)16-3/h4-6,9,12,14H,7-8H2,1-3H3.
What are the key properties of 5-(2,5-dimethoxyphenyl)-2-methylmorpholine?
5-(2,5-dimethoxyphenyl)-2-methylmorpholine has a molecular weight of 237.30 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dimethoxyphenyl)-2-methylmorpholine is sourced from PubChem (CID 82291906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).