2-methoxy-N,N-dipentylacetamide

C13H27NO2 — CID 60776145

IUPAC2-methoxy-N,N-dipentylacetamide
SMILESCCCCCN(CCCCC)C(=O)COC
InChIInChI=1S/C13H27NO2/c1-4-6-8-10-14(11-9-7-5-2)13(15)12-16-3/h4-12H2,1-3H3
InChIKeyLXZCDLLRWRYEQZ-UHFFFAOYSA-N
MW229.36 g/mol
LogP2.84
Rot. Bonds10

About 2-methoxy-N,N-dipentylacetamide

2-methoxy-N,N-dipentylacetamide (PubChem CID 60776145) has the molecular formula C13H27NO2 and a molecular weight of 229.36 g/mol. Its IUPAC name is 2-methoxy-N,N-dipentylacetamide.

Molecular Properties

Compound Name2-methoxy-N,N-dipentylacetamide
PubChem CID60776145
Molecular FormulaC13H27NO2
Molecular Weight229.36 g/mol
Exact Mass229.20
IUPAC Name2-methoxy-N,N-dipentylacetamide
SMILESCCCCCN(CCCCC)C(=O)COC
InChIInChI=1S/C13H27NO2/c1-4-6-8-10-14(11-9-7-5-2)13(15)12-16-3/h4-12H2,1-3H3
InChIKeyLXZCDLLRWRYEQZ-UHFFFAOYSA-N
XLogP2.84
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.36
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-N-(2-hydroxyethyl)-2-methoxyacetamide
CID 20697100
2-[2-(dipentylamino)-2-oxoethoxy]-N,N-dipentylacetamide
CID 102105691
N,N-didecyl-2-[2-(didecylamino)-2-oxoethoxy]acetamide
CID 71346769
2-[2-(didodecylamino)-2-oxoethoxy]-N,N-didodecylacetamide
CID 71406470
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N,N-di(tetradecyl)acetamide
CID 163192847
2-ethoxy-N-hexadecyl-N-tetradecylacetamide
CID 170646131
2-[2-(dimethylamino)ethoxy]-N,N-dipentylacetamide
CID 175987160
[2-(dioctadecylamino)-2-oxoethyl] 2-aminoacetate
CID 54404734
N-(3-aminopropyl)-N-ethyl-2-methoxyacetamide
CID 61276945
2-[3-[2-(dioctylamino)-2-oxoethoxy]-2-[[2-(dioctylamino)-2-oxoethoxy]methyl]-2-methylpropoxy]-N,N-dioctylacetamide
CID 174303360
N,N-di(undecyl)pentanamide
CID 532896
N,N-di(undecyl)butanamide
CID 533369

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N,N-dipentylacetamide?
The IUPAC name of 2-methoxy-N,N-dipentylacetamide (CID 60776145) is 2-methoxy-N,N-dipentylacetamide.
What is the SMILES notation for 2-methoxy-N,N-dipentylacetamide?
The canonical SMILES for 2-methoxy-N,N-dipentylacetamide is CCCCCN(CCCCC)C(=O)COC.
What is the InChIKey of 2-methoxy-N,N-dipentylacetamide?
The InChIKey is LXZCDLLRWRYEQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2/c1-4-6-8-10-14(11-9-7-5-2)13(15)12-16-3/h4-12H2,1-3H3.
What are the key properties of 2-methoxy-N,N-dipentylacetamide?
2-methoxy-N,N-dipentylacetamide has a molecular weight of 229.36 g/mol, XLogP of 2.84, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,N-dipentylacetamide is sourced from PubChem (CID 60776145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).