4-oxo-N-(2-propoxyethyl)pentanamide

C10H19NO3 — CID 58391209

IUPAC4-oxo-N-(2-propoxyethyl)pentanamide
SMILESCCCOCCNC(=O)CCC(C)=O
InChIInChI=1S/C10H19NO3/c1-3-7-14-8-6-11-10(13)5-4-9(2)12/h3-8H2,1-2H3,(H,11,13)
InChIKeyWGFCRSBZSWOJBP-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.90
Rot. Bonds8

About 4-oxo-N-(2-propoxyethyl)pentanamide

4-oxo-N-(2-propoxyethyl)pentanamide (PubChem CID 58391209) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 4-oxo-N-(2-propoxyethyl)pentanamide.

Molecular Properties

Compound Name4-oxo-N-(2-propoxyethyl)pentanamide
PubChem CID58391209
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Name4-oxo-N-(2-propoxyethyl)pentanamide
SMILESCCCOCCNC(=O)CCC(C)=O
InChIInChI=1S/C10H19NO3/c1-3-7-14-8-6-11-10(13)5-4-9(2)12/h3-8H2,1-2H3,(H,11,13)
InChIKeyWGFCRSBZSWOJBP-UHFFFAOYSA-N
XLogP0.90
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-oxo-N-(2-propoxyethyl)pentanamide?
The IUPAC name of 4-oxo-N-(2-propoxyethyl)pentanamide (CID 58391209) is 4-oxo-N-(2-propoxyethyl)pentanamide.
What is the SMILES notation for 4-oxo-N-(2-propoxyethyl)pentanamide?
The canonical SMILES for 4-oxo-N-(2-propoxyethyl)pentanamide is CCCOCCNC(=O)CCC(C)=O.
What is the InChIKey of 4-oxo-N-(2-propoxyethyl)pentanamide?
The InChIKey is WGFCRSBZSWOJBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-3-7-14-8-6-11-10(13)5-4-9(2)12/h3-8H2,1-2H3,(H,11,13).
What are the key properties of 4-oxo-N-(2-propoxyethyl)pentanamide?
4-oxo-N-(2-propoxyethyl)pentanamide has a molecular weight of 201.27 g/mol, XLogP of 0.90, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-oxo-N-(2-propoxyethyl)pentanamide is sourced from PubChem (CID 58391209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).