N-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide

C13H24N2O2 — CID 66725919

IUPACN-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide
SMILESCCCCCC(=O)NN1CC(CCC)CC1=O
InChIInChI=1S/C13H24N2O2/c1-3-5-6-8-12(16)14-15-10-11(7-4-2)9-13(15)17/h11H,3-10H2,1-2H3,(H,14,16)
InChIKeyUFYOGHJXULKVGG-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.25
Rot. Bonds7

About N-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide

N-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide (PubChem CID 66725919) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide.

Molecular Properties

Compound NameN-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide
PubChem CID66725919
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide
SMILESCCCCCC(=O)NN1CC(CCC)CC1=O
InChIInChI=1S/C13H24N2O2/c1-3-5-6-8-12(16)14-15-10-11(7-4-2)9-13(15)17/h11H,3-10H2,1-2H3,(H,14,16)
InChIKeyUFYOGHJXULKVGG-UHFFFAOYSA-N
XLogP2.25
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.25
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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Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide?
The IUPAC name of N-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide (CID 66725919) is N-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide.
What is the SMILES notation for N-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide?
The canonical SMILES for N-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide is CCCCCC(=O)NN1CC(CCC)CC1=O.
What is the InChIKey of N-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide?
The InChIKey is UFYOGHJXULKVGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-3-5-6-8-12(16)14-15-10-11(7-4-2)9-13(15)17/h11H,3-10H2,1-2H3,(H,14,16).
What are the key properties of N-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide?
N-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide has a molecular weight of 240.35 g/mol, XLogP of 2.25, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-4-propylpyrrolidin-1-yl)hexanamide is sourced from PubChem (CID 66725919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).