2-ethoxy-N-propylpropanamide

C8H17NO2 — CID 58332939

IUPAC2-ethoxy-N-propylpropanamide
SMILESCCCNC(=O)C(C)OCC
InChIInChI=1S/C8H17NO2/c1-4-6-9-8(10)7(3)11-5-2/h7H,4-6H2,1-3H3,(H,9,10)
InChIKeyARIBDWSRFOPUCQ-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.94
Rot. Bonds5

About 2-ethoxy-N-propylpropanamide

2-ethoxy-N-propylpropanamide (PubChem CID 58332939) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is 2-ethoxy-N-propylpropanamide.

Molecular Properties

Compound Name2-ethoxy-N-propylpropanamide
PubChem CID58332939
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name2-ethoxy-N-propylpropanamide
SMILESCCCNC(=O)C(C)OCC
InChIInChI=1S/C8H17NO2/c1-4-6-9-8(10)7(3)11-5-2/h7H,4-6H2,1-3H3,(H,9,10)
InChIKeyARIBDWSRFOPUCQ-UHFFFAOYSA-N
XLogP0.94
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-propylpropanamide?
The IUPAC name of 2-ethoxy-N-propylpropanamide (CID 58332939) is 2-ethoxy-N-propylpropanamide.
What is the SMILES notation for 2-ethoxy-N-propylpropanamide?
The canonical SMILES for 2-ethoxy-N-propylpropanamide is CCCNC(=O)C(C)OCC.
What is the InChIKey of 2-ethoxy-N-propylpropanamide?
The InChIKey is ARIBDWSRFOPUCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-4-6-9-8(10)7(3)11-5-2/h7H,4-6H2,1-3H3,(H,9,10).
What are the key properties of 2-ethoxy-N-propylpropanamide?
2-ethoxy-N-propylpropanamide has a molecular weight of 159.23 g/mol, XLogP of 0.94, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-propylpropanamide is sourced from PubChem (CID 58332939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).