N-[11-[(2-methoxyacetyl)amino]undecyl]propanamide

C17H34N2O3 — CID 155455429

IUPACN-[11-[(2-methoxyacetyl)amino]undecyl]propanamide
SMILESCCC(=O)NCCCCCCCCCCCNC(=O)COC
InChIInChI=1S/C17H34N2O3/c1-3-16(20)18-13-11-9-7-5-4-6-8-10-12-14-19-17(21)15-22-2/h3-15H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyHGIRDVUQSVUNOF-UHFFFAOYSA-N
MW314.47 g/mol
LogP2.79
Rot. Bonds15

About N-[11-[(2-methoxyacetyl)amino]undecyl]propanamide

N-[11-[(2-methoxyacetyl)amino]undecyl]propanamide (PubChem CID 155455429) has the molecular formula C17H34N2O3 and a molecular weight of 314.47 g/mol. Its IUPAC name is N-[11-[(2-methoxyacetyl)amino]undecyl]propanamide.

Molecular Properties

Compound NameN-[11-[(2-methoxyacetyl)amino]undecyl]propanamide
PubChem CID155455429
Molecular FormulaC17H34N2O3
Molecular Weight314.47 g/mol
Exact Mass314.26
IUPAC NameN-[11-[(2-methoxyacetyl)amino]undecyl]propanamide
SMILESCCC(=O)NCCCCCCCCCCCNC(=O)COC
InChIInChI=1S/C17H34N2O3/c1-3-16(20)18-13-11-9-7-5-4-6-8-10-12-14-19-17(21)15-22-2/h3-15H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyHGIRDVUQSVUNOF-UHFFFAOYSA-N
XLogP2.79
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.47
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-methoxy-N-nonylacetamide
CID 86922058
ethane;N-[2-[(2-methoxyacetyl)amino]ethyl]propanamide
CID 156794805
2-methoxy-N-(6-methoxyhexyl)acetamide
CID 177338017
N-[2-[2-[(2-methoxyacetyl)amino]ethoxy]ethyl]propanamide
CID 118258329
ethane;N-undecylpropanamide
CID 155706114
N-[7-[(2-chloroacetyl)amino]heptyl]propanamide
CID 163838006
N-(6,10-dioxoundecyl)-2-methoxyacetamide
CID 167591874
2-methoxy-N-(3-trimethoxysilylpropyl)acetamide
CID 102479159
2-methoxy-N-(3-propoxypropyl)acetamide
CID 82947081
N-[5-(5-acetamidopentoxy)pentyl]-2-methoxyacetamide;ethane
CID 163400462
N-[10-[(2-hydroxyacetyl)amino]decyl]propanamide;neodymium
CID 171554602
N-(5-ethoxypentyl)propanamide
CID 91349564

Frequently Asked Questions

What is the IUPAC name of N-[11-[(2-methoxyacetyl)amino]undecyl]propanamide?
The IUPAC name of N-[11-[(2-methoxyacetyl)amino]undecyl]propanamide (CID 155455429) is N-[11-[(2-methoxyacetyl)amino]undecyl]propanamide.
What is the SMILES notation for N-[11-[(2-methoxyacetyl)amino]undecyl]propanamide?
The canonical SMILES for N-[11-[(2-methoxyacetyl)amino]undecyl]propanamide is CCC(=O)NCCCCCCCCCCCNC(=O)COC.
What is the InChIKey of N-[11-[(2-methoxyacetyl)amino]undecyl]propanamide?
The InChIKey is HGIRDVUQSVUNOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O3/c1-3-16(20)18-13-11-9-7-5-4-6-8-10-12-14-19-17(21)15-22-2/h3-15H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of N-[11-[(2-methoxyacetyl)amino]undecyl]propanamide?
N-[11-[(2-methoxyacetyl)amino]undecyl]propanamide has a molecular weight of 314.47 g/mol, XLogP of 2.79, 15 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[11-[(2-methoxyacetyl)amino]undecyl]propanamide is sourced from PubChem (CID 155455429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).