N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide

C11H20N2O2 — CID 123515256

IUPACN-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide
SMILESCCCC(=O)NCCCN1CCCC1=O
InChIInChI=1S/C11H20N2O2/c1-2-5-10(14)12-7-4-9-13-8-3-6-11(13)15/h2-9H2,1H3,(H,12,14)
InChIKeyMEGGPKFWKPMZAY-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.92
Rot. Bonds6

About N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide

N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide (PubChem CID 123515256) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide.

Molecular Properties

Compound NameN-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide
PubChem CID123515256
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC NameN-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide
SMILESCCCC(=O)NCCCN1CCCC1=O
InChIInChI=1S/C11H20N2O2/c1-2-5-10(14)12-7-4-9-13-8-3-6-11(13)15/h2-9H2,1H3,(H,12,14)
InChIKeyMEGGPKFWKPMZAY-UHFFFAOYSA-N
XLogP0.92
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.92
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

7-amino-N-[3-(2-oxopyrrolidin-1-yl)propyl]heptanamide
CID 119671569
2-(diethylamino)-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
CID 86977577
2-(2-oxopiperidin-1-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
CID 86984731
dimethyl-[2-oxo-2-[3-(2-oxopyrrolidin-1-yl)propylamino]ethyl]-tetradecylazanium
CID 121391981
2-[2-[2-oxo-2-[3-(2-oxopyrrolidin-1-yl)propylamino]ethoxy]ethoxy]-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
CID 574581
2-chloro-N-[3-(2-oxoazepan-1-yl)propyl]acetamide
CID 54592450
1-dodecylpyrrolidin-2-one
CID 70222371
1-hexylpyrrolidin-2-one
CID 158904818
4-[3-(2-oxopiperidin-1-yl)propanoylamino]butanamide
CID 139517074
N'-tert-butyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]oxamide
CID 45000134
4-[3-(2-oxopiperidin-1-yl)propanoylamino]butanoic acid
CID 139516844
(E)-2-methyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]pent-2-enamide
CID 98444091

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide?
The IUPAC name of N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide (CID 123515256) is N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide.
What is the SMILES notation for N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide?
The canonical SMILES for N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide is CCCC(=O)NCCCN1CCCC1=O.
What is the InChIKey of N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide?
The InChIKey is MEGGPKFWKPMZAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-2-5-10(14)12-7-4-9-13-8-3-6-11(13)15/h2-9H2,1H3,(H,12,14).
What are the key properties of N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide?
N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide has a molecular weight of 212.29 g/mol, XLogP of 0.92, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide is sourced from PubChem (CID 123515256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).