methoxymethane;3-methoxy-2-methyl-N-[2-[[1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]amino]-2-oxoethyl]propanamide;2-methylpropane

C20H40N2O6 — CID 143460413

About methoxymethane;3-methoxy-2-methyl-N-[2-[[1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]amino]-2-oxoethyl]propanamide;2-methylpropane

methoxymethane;3-methoxy-2-methyl-N-[2-[[1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]amino]-2-oxoethyl]propanamide;2-methylpropane (PubChem CID 143460413) has the molecular formula C20H40N2O6 and a molecular weight of 404.55 g/mol. Its IUPAC name is methoxymethane;3-methoxy-2-methyl-N-[2-[[1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]amino]-2-oxoethyl]propanamide;2-methylpropane.

Molecular Properties

• Compound Name: methoxymethane;3-methoxy-2-methyl-N-[2-[[1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]amino]-2-oxoethyl]propanamide;2-methylpropane
• PubChem CID: 143460413
• Molecular Formula: C20H40N2O6
• Molecular Weight: 404.55 g/mol
• Exact Mass: 404.29
• IUPAC Name: methoxymethane;3-methoxy-2-methyl-N-[2-[[1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]amino]-2-oxoethyl]propanamide;2-methylpropane
• SMILES: CC(C)C.CCC(NC(=O)CNC(=O)C(C)COC)C(=O)C1(C)CO1.COC
• InChI: InChI=1S/C14H24N2O5.C4H10.C2H6O/c1-5-10(12(18)14(3)8-21-14)16-11(17)6-15-13(19)9(2)7-20-4;1-4(2)3;1-3-2/h9-10H,5-8H2,1-4H3,(H,15,19)(H,16,17);4H,1-3H3;1-2H3
• InChIKey: WAUPDVQMOCJNON-UHFFFAOYSA-N
• XLogP: 1.56
• TPSA: 106.26 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 9
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	404.55
LogP ≤ 5	1.56
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of methoxymethane;3-methoxy-2-methyl-N-[2-[[1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]amino]-2-oxoethyl]propanamide;2-methylpropane?

The IUPAC name of methoxymethane;3-methoxy-2-methyl-N-[2-[[1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]amino]-2-oxoethyl]propanamide;2-methylpropane (CID 143460413) is methoxymethane;3-methoxy-2-methyl-N-[2-[[1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]amino]-2-oxoethyl]propanamide;2-methylpropane.

What is the SMILES notation for methoxymethane;3-methoxy-2-methyl-N-[2-[[1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]amino]-2-oxoethyl]propanamide;2-methylpropane?

The canonical SMILES for methoxymethane;3-methoxy-2-methyl-N-[2-[[1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]amino]-2-oxoethyl]propanamide;2-methylpropane is CC(C)C.CCC(NC(=O)CNC(=O)C(C)COC)C(=O)C1(C)CO1.COC.

What is the InChIKey of methoxymethane;3-methoxy-2-methyl-N-[2-[[1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]amino]-2-oxoethyl]propanamide;2-methylpropane?

The InChIKey is WAUPDVQMOCJNON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O5.C4H10.C2H6O/c1-5-10(12(18)14(3)8-21-14)16-11(17)6-15-13(19)9(2)7-20-4;1-4(2)3;1-3-2/h9-10H,5-8H2,1-4H3,(H,15,19)(H,16,17);4H,1-3H3;1-2H3.

What are the key properties of methoxymethane;3-methoxy-2-methyl-N-[2-[[1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]amino]-2-oxoethyl]propanamide;2-methylpropane?

methoxymethane;3-methoxy-2-methyl-N-[2-[[1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]amino]-2-oxoethyl]propanamide;2-methylpropane has a molecular weight of 404.55 g/mol, XLogP of 1.56, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for methoxymethane;3-methoxy-2-methyl-N-[2-[[1-(2-methyloxiran-2-yl)-1-oxobutan-2-yl]amino]-2-oxoethyl]propanamide;2-methylpropane is sourced from PubChem (CID 143460413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).