[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone

C20H23NO4 — CID 46041087

IUPAC[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone
SMILESCOc1ccc(OCC2CN(C(=O)c3ccc(C)cc3)CCO2)cc1
InChIInChI=1S/C20H23NO4/c1-15-3-5-16(6-4-15)20(22)21-11-12-24-19(13-21)14-25-18-9-7-17(23-2)8-10-18/h3-10,19H,11-14H2,1-2H3
InChIKeyIAYIVTIOHTYYPO-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.92
Rot. Bonds5

About [2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone

[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone (PubChem CID 46041087) has the molecular formula C20H23NO4 and a molecular weight of 341.41 g/mol. Its IUPAC name is [2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone.

Molecular Properties

Compound Name[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone
PubChem CID46041087
Molecular FormulaC20H23NO4
Molecular Weight341.41 g/mol
Exact Mass341.16
IUPAC Name[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone
SMILESCOc1ccc(OCC2CN(C(=O)c3ccc(C)cc3)CCO2)cc1
InChIInChI=1S/C20H23NO4/c1-15-3-5-16(6-4-15)20(22)21-11-12-24-19(13-21)14-25-18-9-7-17(23-2)8-10-18/h3-10,19H,11-14H2,1-2H3
InChIKeyIAYIVTIOHTYYPO-UHFFFAOYSA-N
XLogP2.92
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone with MolForge

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Related Compounds

[(2R)-2-[(3-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone
CID 93327745
furan-3-yl-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]methanone
CID 42861355
(3,4-difluorophenyl)-[2-[(4-methylphenoxy)methyl]morpholin-4-yl]methanone
CID 46100398
[(2S)-2-(aminomethyl)morpholin-4-yl]-(4-methoxyphenyl)methanone
CID 42252495
2-(4-methylphenoxy)-1-[(2S)-2-[(4-methylphenoxy)methyl]morpholin-4-yl]ethanone
CID 92757449
(6-bromo-2-pyridinyl)-[2-[(4-methylphenoxy)methyl]morpholin-4-yl]methanone
CID 46100358
[2-[(4-fluorophenoxy)methyl]morpholin-4-yl]-phenylmethanone
CID 46041108
1-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-2-phenylethanone
CID 46041088
2-(4-fluorophenoxy)-1-[2-[(4-methylphenoxy)methyl]morpholin-4-yl]ethanone
CID 129316369
2-(3,5-dimethoxyphenyl)-1-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]ethanone
CID 46100167
(2,6-difluoro-4-methoxyphenyl)-[(2R)-2-(phenoxymethyl)morpholin-4-yl]methanone
CID 92758340
[2-[(3,4-difluorophenoxy)methyl]morpholin-4-yl]-(4-fluorophenyl)methanone
CID 42849205

Frequently Asked Questions

What is the IUPAC name of [2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone?
The IUPAC name of [2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone (CID 46041087) is [2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone.
What is the SMILES notation for [2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone?
The canonical SMILES for [2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone is COc1ccc(OCC2CN(C(=O)c3ccc(C)cc3)CCO2)cc1.
What is the InChIKey of [2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone?
The InChIKey is IAYIVTIOHTYYPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO4/c1-15-3-5-16(6-4-15)20(22)21-11-12-24-19(13-21)14-25-18-9-7-17(23-2)8-10-18/h3-10,19H,11-14H2,1-2H3.
What are the key properties of [2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone?
[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone has a molecular weight of 341.41 g/mol, XLogP of 2.92, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone is sourced from PubChem (CID 46041087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).