N-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide

C15H30N2O3 — CID 134334637

IUPACN-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide
SMILESCOCC(=O)NCCCCCNC(=O)C(C)(C)C(C)C
InChIInChI=1S/C15H30N2O3/c1-12(2)15(3,4)14(19)17-10-8-6-7-9-16-13(18)11-20-5/h12H,6-11H2,1-5H3,(H,16,18)(H,17,19)
InChIKeyJHTRZZOCWCGOAB-UHFFFAOYSA-N
MW286.42 g/mol
LogP1.72
Rot. Bonds10

About N-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide

N-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide (PubChem CID 134334637) has the molecular formula C15H30N2O3 and a molecular weight of 286.42 g/mol. Its IUPAC name is N-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide.

Molecular Properties

Compound NameN-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide
PubChem CID134334637
Molecular FormulaC15H30N2O3
Molecular Weight286.42 g/mol
Exact Mass286.23
IUPAC NameN-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide
SMILESCOCC(=O)NCCCCCNC(=O)C(C)(C)C(C)C
InChIInChI=1S/C15H30N2O3/c1-12(2)15(3,4)14(19)17-10-8-6-7-9-16-13(18)11-20-5/h12H,6-11H2,1-5H3,(H,16,18)(H,17,19)
InChIKeyJHTRZZOCWCGOAB-UHFFFAOYSA-N
XLogP1.72
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 51.72
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
N-[11-[(2-methoxyacetyl)amino]undecyl]propanamide
CID 155455429
2-methoxy-N-(6-methoxyhexyl)acetamide
CID 177338017
N-(6,10-dioxoundecyl)-2-methoxyacetamide
CID 167591874
N-[2-[(2-methoxyacetyl)amino]ethyl]-3-methylbutanamide
CID 108538544
2-methoxy-N-(3-trimethoxysilylpropyl)acetamide
CID 102479159
2,2,3,3-tetramethyl-N-[2-(2,2,3-trimethylbutanoylamino)ethyl]butanamide
CID 59105475
N-[5-(5-acetamidopentoxy)pentyl]-2-methoxyacetamide;ethane
CID 163400462
N-[3-[3-(tert-butylamino)propoxy]propyl]-2-methoxyacetamide
CID 135296593
N-butyl-2,6-bis[(2-methoxyacetyl)amino]hexanamide
CID 159839160
N-[8-(phosphanylcarbonylamino)octyl]-2-propan-2-yloxyacetamide
CID 157048781
N-(4-methoxybutyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605413

Frequently Asked Questions

What is the IUPAC name of N-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide?
The IUPAC name of N-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide (CID 134334637) is N-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide.
What is the SMILES notation for N-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide?
The canonical SMILES for N-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide is COCC(=O)NCCCCCNC(=O)C(C)(C)C(C)C.
What is the InChIKey of N-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide?
The InChIKey is JHTRZZOCWCGOAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O3/c1-12(2)15(3,4)14(19)17-10-8-6-7-9-16-13(18)11-20-5/h12H,6-11H2,1-5H3,(H,16,18)(H,17,19).
What are the key properties of N-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide?
N-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide has a molecular weight of 286.42 g/mol, XLogP of 1.72, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(2-methoxyacetyl)amino]pentyl]-2,2,3-trimethylbutanamide is sourced from PubChem (CID 134334637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).