ethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide

C15H36N2O3 — CID 176551860

IUPACethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide
SMILESCC.CC.CNCCCCOCCCNC(=O)COC
InChIInChI=1S/C11H24N2O3.2C2H6/c1-12-6-3-4-8-16-9-5-7-13-11(14)10-15-2;2*1-2/h12H,3-10H2,1-2H3,(H,13,14);2*1-2H3
InChIKeyODROZNAPLJQRRE-UHFFFAOYSA-N
MW292.46 g/mol
LogP2.21
Rot. Bonds11

About ethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide

ethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide (PubChem CID 176551860) has the molecular formula C15H36N2O3 and a molecular weight of 292.46 g/mol. Its IUPAC name is ethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide.

Molecular Properties

Compound Nameethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide
PubChem CID176551860
Molecular FormulaC15H36N2O3
Molecular Weight292.46 g/mol
Exact Mass292.27
IUPAC Nameethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide
SMILESCC.CC.CNCCCCOCCCNC(=O)COC
InChIInChI=1S/C11H24N2O3.2C2H6/c1-12-6-3-4-8-16-9-5-7-13-11(14)10-15-2;2*1-2/h12H,3-10H2,1-2H3,(H,13,14);2*1-2H3
InChIKeyODROZNAPLJQRRE-UHFFFAOYSA-N
XLogP2.21
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.46
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze ethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[5-(5-acetamidopentoxy)pentyl]-2-methoxyacetamide;ethane
CID 163400462
2-methoxy-N-(3-propoxypropyl)acetamide
CID 82947081
2-methoxy-N-(6-methoxyhexyl)acetamide
CID 177338017
N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide
CID 155056819
N-[3-[3-(tert-butylamino)propoxy]propyl]-2-methoxyacetamide
CID 135296593
N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide;ethane;methane
CID 178085327
N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide
CID 155715449
2-(2-methoxyethoxy)-N-(3-methoxypropyl)acetamide
CID 103601588
2-[2-[2-[5-[[2-(2-butoxyethoxy)acetyl]amino]pentoxy]ethoxy]ethoxy]-N-methylacetamide
CID 134582817
ethane;3-(4-methoxybutoxy)-N-[2-(methylamino)ethyl]propanamide
CID 153398683
2-(2-aminoethoxy)-N-[3-(2-methoxyethoxy)propyl]acetamide
CID 79473525
1-[4-(methylamino)butoxy]propan-2-one
CID 155218362

Frequently Asked Questions

What is the IUPAC name of ethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide?
The IUPAC name of ethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide (CID 176551860) is ethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide.
What is the SMILES notation for ethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide?
The canonical SMILES for ethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide is CC.CC.CNCCCCOCCCNC(=O)COC.
What is the InChIKey of ethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide?
The InChIKey is ODROZNAPLJQRRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3.2C2H6/c1-12-6-3-4-8-16-9-5-7-13-11(14)10-15-2;2*1-2/h12H,3-10H2,1-2H3,(H,13,14);2*1-2H3.
What are the key properties of ethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide?
ethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide has a molecular weight of 292.46 g/mol, XLogP of 2.21, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide is sourced from PubChem (CID 176551860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).