2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine

C20H25NO3 — CID 74337094

IUPAC2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine
SMILESCCOc1ccccc1OC(c1ccc(C)cc1)C1CNCCO1
InChIInChI=1S/C20H25NO3/c1-3-22-17-6-4-5-7-18(17)24-20(19-14-21-12-13-23-19)16-10-8-15(2)9-11-16/h4-11,19-21H,3,12-14H2,1-2H3
InChIKeyHJVZCLONWLVSGP-UHFFFAOYSA-N
MW327.42 g/mol
LogP3.50
Rot. Bonds6

About 2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine

2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine (PubChem CID 74337094) has the molecular formula C20H25NO3 and a molecular weight of 327.42 g/mol. Its IUPAC name is 2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine.

Molecular Properties

Compound Name2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine
PubChem CID74337094
Molecular FormulaC20H25NO3
Molecular Weight327.42 g/mol
Exact Mass327.18
IUPAC Name2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine
SMILESCCOc1ccccc1OC(c1ccc(C)cc1)C1CNCCO1
InChIInChI=1S/C20H25NO3/c1-3-22-17-6-4-5-7-18(17)24-20(19-14-21-12-13-23-19)16-10-8-15(2)9-11-16/h4-11,19-21H,3,12-14H2,1-2H3
InChIKeyHJVZCLONWLVSGP-UHFFFAOYSA-N
XLogP3.50
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.42
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine?
The IUPAC name of 2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine (CID 74337094) is 2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine.
What is the SMILES notation for 2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine?
The canonical SMILES for 2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine is CCOc1ccccc1OC(c1ccc(C)cc1)C1CNCCO1.
What is the InChIKey of 2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine?
The InChIKey is HJVZCLONWLVSGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO3/c1-3-22-17-6-4-5-7-18(17)24-20(19-14-21-12-13-23-19)16-10-8-15(2)9-11-16/h4-11,19-21H,3,12-14H2,1-2H3.
What are the key properties of 2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine?
2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine has a molecular weight of 327.42 g/mol, XLogP of 3.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine is sourced from PubChem (CID 74337094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).