N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide

C20H39N3O9 — CID 89101434

IUPACN-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide
SMILESCCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NC
InChIInChI=1S/C20H39N3O9/c1-3-6-27-9-12-31-16-19(25)22-5-8-29-11-14-32-17-20(26)23-4-7-28-10-13-30-15-18(24)21-2/h3-17H2,1-2H3,(H,21,24)(H,22,25)(H,23,26)
InChIKeyILOCTBVKOKJQPC-UHFFFAOYSA-N
MW465.54 g/mol
LogP-1.53
Rot. Bonds23

About N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide

N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide (PubChem CID 89101434) has the molecular formula C20H39N3O9 and a molecular weight of 465.54 g/mol. Its IUPAC name is N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide.

Molecular Properties

Compound NameN-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide
PubChem CID89101434
Molecular FormulaC20H39N3O9
Molecular Weight465.54 g/mol
Exact Mass465.27
IUPAC NameN-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide
SMILESCCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NC
InChIInChI=1S/C20H39N3O9/c1-3-6-27-9-12-31-16-19(25)22-5-8-29-11-14-32-17-20(26)23-4-7-28-10-13-30-15-18(24)21-2/h3-17H2,1-2H3,(H,21,24)(H,22,25)(H,23,26)
InChIKeyILOCTBVKOKJQPC-UHFFFAOYSA-N
XLogP-1.53
TPSA142.68 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds23
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.54
LogP ≤ 5-1.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-[2-[[2-(2-ethoxyethoxy)acetyl]amino]ethoxy]ethoxy]-N-methylacetamide
CID 139325518
N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide
CID 89176591
2-(2-propoxyethoxy)-N-propylacetamide
CID 149463198
N-[2-(2-aminoethoxy)ethyl]-2-propoxyacetamide
CID 107941598
2-(2-oxopropoxy)-N-[2-(2-propoxyethoxy)ethyl]acetamide
CID 123445865
ethane;2-ethoxy-N-[2-[2-[2-[2-[(2-ethoxyacetyl)amino]ethoxy]ethoxy]ethoxy]ethyl]acetamide
CID 142043663
ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury
CID 171823735
2-bromo-N-[2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide
CID 90995903
N-methyl-N'-[2-(2-propoxyethoxy)ethyl]pentanediamide
CID 176584959
2-[2-[2-[5-[[2-(2-butoxyethoxy)acetyl]amino]pentoxy]ethoxy]ethoxy]-N-methylacetamide
CID 134582817
2-ethoxy-N-[2-[2-[2-[2-[(2-ethoxyacetyl)amino]ethoxy]ethoxy]ethoxy]ethyl]acetamide
CID 142043664
ethane;2-[2-[2-(ethylamino)ethoxy]ethoxy]-N-methylacetamide
CID 163399935

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide?
The IUPAC name of N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide (CID 89101434) is N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide.
What is the SMILES notation for N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide?
The canonical SMILES for N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide is CCCOCCOCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NC.
What is the InChIKey of N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide?
The InChIKey is ILOCTBVKOKJQPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H39N3O9/c1-3-6-27-9-12-31-16-19(25)22-5-8-29-11-14-32-17-20(26)23-4-7-28-10-13-30-15-18(24)21-2/h3-17H2,1-2H3,(H,21,24)(H,22,25)(H,23,26).
What are the key properties of N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide?
N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide has a molecular weight of 465.54 g/mol, XLogP of -1.53, 23 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide is sourced from PubChem (CID 89101434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).