2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine

C14H21NO2 — CID 145267911

IUPAC2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine
SMILESCOCC1CNC(Cc2ccc(C)cc2)CO1
InChIInChI=1S/C14H21NO2/c1-11-3-5-12(6-4-11)7-13-9-17-14(8-15-13)10-16-2/h3-6,13-15H,7-10H2,1-2H3
InChIKeyPVFWFTMOQZIKGF-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.54
Rot. Bonds4

About 2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine

2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine (PubChem CID 145267911) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine.

Molecular Properties

Compound Name2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine
PubChem CID145267911
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine
SMILESCOCC1CNC(Cc2ccc(C)cc2)CO1
InChIInChI=1S/C14H21NO2/c1-11-3-5-12(6-4-11)7-13-9-17-14(8-15-13)10-16-2/h3-6,13-15H,7-10H2,1-2H3
InChIKeyPVFWFTMOQZIKGF-UHFFFAOYSA-N
XLogP1.54
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine?
The IUPAC name of 2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine (CID 145267911) is 2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine.
What is the SMILES notation for 2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine?
The canonical SMILES for 2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine is COCC1CNC(Cc2ccc(C)cc2)CO1.
What is the InChIKey of 2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine?
The InChIKey is PVFWFTMOQZIKGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-11-3-5-12(6-4-11)7-13-9-17-14(8-15-13)10-16-2/h3-6,13-15H,7-10H2,1-2H3.
What are the key properties of 2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine?
2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine has a molecular weight of 235.33 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-5-[(4-methylphenyl)methyl]morpholine is sourced from PubChem (CID 145267911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).