5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide

C15H27N3O2 — CID 119427312

IUPAC5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide
SMILESCCCC(C)N1CC(C(=O)NC2CCCNC2)CC1=O
InChIInChI=1S/C15H27N3O2/c1-3-5-11(2)18-10-12(8-14(18)19)15(20)17-13-6-4-7-16-9-13/h11-13,16H,3-10H2,1-2H3,(H,17,20)
InChIKeyZQZNXSJVZDCCGL-UHFFFAOYSA-N
MW281.40 g/mol
LogP0.89
Rot. Bonds5

About 5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide

5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide (PubChem CID 119427312) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide.

Molecular Properties

Compound Name5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide
PubChem CID119427312
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide
SMILESCCCC(C)N1CC(C(=O)NC2CCCNC2)CC1=O
InChIInChI=1S/C15H27N3O2/c1-3-5-11(2)18-10-12(8-14(18)19)15(20)17-13-6-4-7-16-9-13/h11-13,16H,3-10H2,1-2H3,(H,17,20)
InChIKeyZQZNXSJVZDCCGL-UHFFFAOYSA-N
XLogP0.89
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide?
The IUPAC name of 5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide (CID 119427312) is 5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide.
What is the SMILES notation for 5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide?
The canonical SMILES for 5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide is CCCC(C)N1CC(C(=O)NC2CCCNC2)CC1=O.
What is the InChIKey of 5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide?
The InChIKey is ZQZNXSJVZDCCGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-3-5-11(2)18-10-12(8-14(18)19)15(20)17-13-6-4-7-16-9-13/h11-13,16H,3-10H2,1-2H3,(H,17,20).
What are the key properties of 5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide?
5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide has a molecular weight of 281.40 g/mol, XLogP of 0.89, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-1-pentan-2-yl-N-piperidin-3-ylpyrrolidine-3-carboxamide is sourced from PubChem (CID 119427312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).