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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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).