2-ethyl-N-methyl-5-oxopentanamide

C8H15NO2 — CID 145371597

IUPAC2-ethyl-N-methyl-5-oxopentanamide
SMILESCCC(CCC=O)C(=O)NC
InChIInChI=1S/C8H15NO2/c1-3-7(5-4-6-10)8(11)9-2/h6-7H,3-5H2,1-2H3,(H,9,11)
InChIKeyLGSXKIRGQWKNGB-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.74
Rot. Bonds5

About 2-ethyl-N-methyl-5-oxopentanamide

2-ethyl-N-methyl-5-oxopentanamide (PubChem CID 145371597) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 2-ethyl-N-methyl-5-oxopentanamide.

Molecular Properties

Compound Name2-ethyl-N-methyl-5-oxopentanamide
PubChem CID145371597
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name2-ethyl-N-methyl-5-oxopentanamide
SMILESCCC(CCC=O)C(=O)NC
InChIInChI=1S/C8H15NO2/c1-3-7(5-4-6-10)8(11)9-2/h6-7H,3-5H2,1-2H3,(H,9,11)
InChIKeyLGSXKIRGQWKNGB-UHFFFAOYSA-N
XLogP0.74
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

methyl 2-ethyl-5-oxopentanoate
CID 10997312
N-methyl-2-(3-oxopropyl)pent-4-enamide
CID 142360160
2-[[ethyl(methyl)amino]methyl]-N-methyl-5-oxopentanamide
CID 143767998
2-ethyl-N-methylpentanamide
CID 55287466
N,2-dimethyl-5-oxopentanamide
CID 20693317
2-ethyl-N-methylpentanamide;molecular hydrogen
CID 142188922
2-ethyl-N-methyltetradecanamide
CID 161072731
2-(hydroxymethyl)-N-methylbutanamide
CID 58973980
2-[formyl(methyl)amino]-N-methyl-5-oxopentanamide
CID 142365578
methyl 2-(2-deuterioethyl)-5-oxopentanoate
CID 58697694
(2S,4S)-2-ethyl-4-formamido-N-methyl-5-oxopentanamide
CID 166157030
2-ethyl-N,4,4-trimethylpentanamide;propane
CID 144536587

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-methyl-5-oxopentanamide?
The IUPAC name of 2-ethyl-N-methyl-5-oxopentanamide (CID 145371597) is 2-ethyl-N-methyl-5-oxopentanamide.
What is the SMILES notation for 2-ethyl-N-methyl-5-oxopentanamide?
The canonical SMILES for 2-ethyl-N-methyl-5-oxopentanamide is CCC(CCC=O)C(=O)NC.
What is the InChIKey of 2-ethyl-N-methyl-5-oxopentanamide?
The InChIKey is LGSXKIRGQWKNGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-3-7(5-4-6-10)8(11)9-2/h6-7H,3-5H2,1-2H3,(H,9,11).
What are the key properties of 2-ethyl-N-methyl-5-oxopentanamide?
2-ethyl-N-methyl-5-oxopentanamide has a molecular weight of 157.21 g/mol, XLogP of 0.74, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-methyl-5-oxopentanamide is sourced from PubChem (CID 145371597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).