methoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide

C21H35N3O5 — CID 143227695

IUPACmethoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide
SMILESCOC.COCc1cc(N(C)C(=O)CN2CCOCC2)ccc1N1CCOCC1
InChIInChI=1S/C19H29N3O4.C2H6O/c1-20(19(23)14-21-5-9-25-10-6-21)17-3-4-18(16(13-17)15-24-2)22-7-11-26-12-8-22;1-3-2/h3-4,13H,5-12,14-15H2,1-2H3;1-2H3
InChIKeyMWYKZZXTIUKXER-UHFFFAOYSA-N
MW409.53 g/mol
LogP1.23
Rot. Bonds6

About methoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide

methoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide (PubChem CID 143227695) has the molecular formula C21H35N3O5 and a molecular weight of 409.53 g/mol. Its IUPAC name is methoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide.

Molecular Properties

Compound Namemethoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide
PubChem CID143227695
Molecular FormulaC21H35N3O5
Molecular Weight409.53 g/mol
Exact Mass409.26
IUPAC Namemethoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide
SMILESCOC.COCc1cc(N(C)C(=O)CN2CCOCC2)ccc1N1CCOCC1
InChIInChI=1S/C19H29N3O4.C2H6O/c1-20(19(23)14-21-5-9-25-10-6-21)17-3-4-18(16(13-17)15-24-2)22-7-11-26-12-8-22;1-3-2/h3-4,13H,5-12,14-15H2,1-2H3;1-2H3
InChIKeyMWYKZZXTIUKXER-UHFFFAOYSA-N
XLogP1.23
TPSA63.71 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.53
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

2-(dimethylamino)-N-(fluoromethyl)-N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]acetamide
CID 70876654
1-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]pyrrolidin-2-one
CID 59165535
N-(3,4-dimethoxyphenyl)-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide
CID 110612863
methyl 2-[5-[methyl-[(E)-3-thiophen-2-ylprop-2-enoyl]amino]-2-morpholin-4-ylphenyl]acetate
CID 71029944
N-methyl-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-N-phenylacetamide
CID 60503563
[2-[methyl-(2-morpholin-4-ylacetyl)amino]-4-[(2-methylpropan-2-yl)oxycarbonyl]thieno[3,2-b]pyrrol-5-yl]boronic acid
CID 90046276
2-amino-N-methyl-6-[methyl-(2-morpholin-4-ylacetyl)amino]-1H-indole-3-carboxamide
CID 123476896
methyl 4-[(2-morpholin-4-ylacetyl)-phenylmethoxyamino]benzoate
CID 142799155
N-(3-cyano-4-morpholin-4-ylphenyl)-2,2,2-trifluoro-N-methylacetamide
CID 91677372
N,N,N'-trimethyl-N'-[3-(2-morpholin-4-ylethoxy)phenyl]butanediamide
CID 23557227
N-[2-(1-ethoxyethenyl)phenyl]-N-methyl-2-morpholin-4-ylacetamide
CID 70176279
prop-2-ynyl 5-[methyl-(2,2,2-trifluoroacetyl)amino]-2-morpholin-4-ylbenzoate
CID 91677222

Frequently Asked Questions

What is the IUPAC name of methoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide?
The IUPAC name of methoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide (CID 143227695) is methoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide.
What is the SMILES notation for methoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide?
The canonical SMILES for methoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide is COC.COCc1cc(N(C)C(=O)CN2CCOCC2)ccc1N1CCOCC1.
What is the InChIKey of methoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide?
The InChIKey is MWYKZZXTIUKXER-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O4.C2H6O/c1-20(19(23)14-21-5-9-25-10-6-21)17-3-4-18(16(13-17)15-24-2)22-7-11-26-12-8-22;1-3-2/h3-4,13H,5-12,14-15H2,1-2H3;1-2H3.
What are the key properties of methoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide?
methoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide has a molecular weight of 409.53 g/mol, XLogP of 1.23, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethane;N-[3-(methoxymethyl)-4-morpholin-4-ylphenyl]-N-methyl-2-morpholin-4-ylacetamide is sourced from PubChem (CID 143227695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).