3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide

C11H21N3O2 — CID 115738358

IUPAC3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide
SMILESCC(N)CC(=O)NCC(=O)N1CCCCC1
InChIInChI=1S/C11H21N3O2/c1-9(12)7-10(15)13-8-11(16)14-5-3-2-4-6-14/h9H,2-8,12H2,1H3,(H,13,15)
InChIKeyYZCHKWLANYVGDM-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.15
Rot. Bonds4

About 3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide

3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide (PubChem CID 115738358) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide.

Molecular Properties

Compound Name3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide
PubChem CID115738358
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide
SMILESCC(N)CC(=O)NCC(=O)N1CCCCC1
InChIInChI=1S/C11H21N3O2/c1-9(12)7-10(15)13-8-11(16)14-5-3-2-4-6-14/h9H,2-8,12H2,1H3,(H,13,15)
InChIKeyYZCHKWLANYVGDM-UHFFFAOYSA-N
XLogP-0.15
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-amino-1-piperidin-1-ylbutan-1-one
CID 59102647
(2S)-2-amino-N-[2-(azepan-1-yl)-2-oxoethyl]-3-methylbutanamide
CID 82959424
N-[2-(azocan-1-yl)-2-oxoethyl]-3,3-dimethylbutanamide
CID 86828606
3-(4-aminophenyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)butanamide
CID 104502977
N-(2-oxo-2-piperidin-1-ylethyl)-2-(prop-2-ynylamino)acetamide
CID 113281833
N-[2-(azepan-1-yl)-2-oxoethyl]pentanamide
CID 112995931
3-(4-chlorophenyl)-4-methyl-N-(2-oxo-2-piperidin-1-ylethyl)pentanamide
CID 110312179
3-amino-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]butanamide
CID 119769498
2-(1-aminocyclobutyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
CID 112701652
methyl 4-oxo-4-[(2-oxo-2-piperidin-1-ylethyl)amino]butanoate
CID 110712317
N-(2-oxo-2-piperidin-1-ylethyl)-3-piperidin-3-ylbutanamide
CID 115738352
2-methyl-3-oxo-3-[(2-oxo-2-piperidin-1-ylethyl)amino]propanoic acid
CID 114898939

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide?
The IUPAC name of 3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide (CID 115738358) is 3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide.
What is the SMILES notation for 3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide?
The canonical SMILES for 3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide is CC(N)CC(=O)NCC(=O)N1CCCCC1.
What is the InChIKey of 3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide?
The InChIKey is YZCHKWLANYVGDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-9(12)7-10(15)13-8-11(16)14-5-3-2-4-6-14/h9H,2-8,12H2,1H3,(H,13,15).
What are the key properties of 3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide?
3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide has a molecular weight of 227.31 g/mol, XLogP of -0.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide is sourced from PubChem (CID 115738358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).