2-ethoxy-N-pentylacetamide

C9H19NO2 — CID 4602072

IUPAC2-ethoxy-N-pentylacetamide
SMILESCCCCCNC(=O)COCC
InChIInChI=1S/C9H19NO2/c1-3-5-6-7-10-9(11)8-12-4-2/h3-8H2,1-2H3,(H,10,11)
InChIKeyYGLNSPNZVQAAGU-UHFFFAOYSA-N
MW173.26 g/mol
LogP1.33
Rot. Bonds7

About 2-ethoxy-N-pentylacetamide

2-ethoxy-N-pentylacetamide (PubChem CID 4602072) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 2-ethoxy-N-pentylacetamide.

Molecular Properties

Compound Name2-ethoxy-N-pentylacetamide
PubChem CID4602072
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name2-ethoxy-N-pentylacetamide
SMILESCCCCCNC(=O)COCC
InChIInChI=1S/C9H19NO2/c1-3-5-6-7-10-9(11)8-12-4-2/h3-8H2,1-2H3,(H,10,11)
InChIKeyYGLNSPNZVQAAGU-UHFFFAOYSA-N
XLogP1.33
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-cycloheptyl-2-methoxyacetamide
CID 936430
Acetamide, 2-butoxy-N-cyclohexyl-
CID 94879
Acetic acid pentadecylcarbamoylmethyl ester
CID 11088732
N-[3-(4-aminobutylamino)propyl]-2-methoxyacetamide;hydrochloride
CID 118721810
N-Ethyl-2-(4-piperidinyloxy)acetamide
CID 20298099
N-(4-aminobutyl)-2-methoxyacetamide;hydrochloride
CID 118721808
N-[4-(3-aminopropylamino)butyl]-2-methoxyacetamide;hydrochloride
CID 118721813
2-methoxy-N-(3-methylbutyl)acetamide
CID 14632091
2-Methoxy-N-(piperidin-4-yl)acetamide
CID 16782129
N-(4-aminocyclohexyl)-2-methoxyacetamide
CID 61279804
N-cyclohexyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 13049545
N-butyl-2-methoxyacetamide
CID 13708111

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-pentylacetamide?
The IUPAC name of 2-ethoxy-N-pentylacetamide (CID 4602072) is 2-ethoxy-N-pentylacetamide.
What is the SMILES notation for 2-ethoxy-N-pentylacetamide?
The canonical SMILES for 2-ethoxy-N-pentylacetamide is CCCCCNC(=O)COCC.
What is the InChIKey of 2-ethoxy-N-pentylacetamide?
The InChIKey is YGLNSPNZVQAAGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-3-5-6-7-10-9(11)8-12-4-2/h3-8H2,1-2H3,(H,10,11).
What are the key properties of 2-ethoxy-N-pentylacetamide?
2-ethoxy-N-pentylacetamide has a molecular weight of 173.26 g/mol, XLogP of 1.33, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-pentylacetamide is sourced from PubChem (CID 4602072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).