(2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide

C11H19N3O3 — CID 99981602

IUPAC(2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide
SMILESC[C@@H](C(=O)NC1COC1)N1C[C@@H](N)CCC1=O
InChIInChI=1S/C11H19N3O3/c1-7(11(16)13-9-5-17-6-9)14-4-8(12)2-3-10(14)15/h7-9H,2-6,12H2,1H3,(H,13,16)/t7-,8-/m0/s1
InChIKeyFTJTZVWEXYCGAT-YUMQZZPRSA-N
MW241.29 g/mol
LogP-1.16
Rot. Bonds3

About (2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide

(2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide (PubChem CID 99981602) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is (2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide.

Molecular Properties

Compound Name(2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide
PubChem CID99981602
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name(2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide
SMILESC[C@@H](C(=O)NC1COC1)N1C[C@@H](N)CCC1=O
InChIInChI=1S/C11H19N3O3/c1-7(11(16)13-9-5-17-6-9)14-4-8(12)2-3-10(14)15/h7-9H,2-6,12H2,1H3,(H,13,16)/t7-,8-/m0/s1
InChIKeyFTJTZVWEXYCGAT-YUMQZZPRSA-N
XLogP-1.16
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 5-1.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide?
The IUPAC name of (2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide (CID 99981602) is (2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide.
What is the SMILES notation for (2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide?
The canonical SMILES for (2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide is C[C@@H](C(=O)NC1COC1)N1C[C@@H](N)CCC1=O.
What is the InChIKey of (2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide?
The InChIKey is FTJTZVWEXYCGAT-YUMQZZPRSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-7(11(16)13-9-5-17-6-9)14-4-8(12)2-3-10(14)15/h7-9H,2-6,12H2,1H3,(H,13,16)/t7-,8-/m0/s1.
What are the key properties of (2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide?
(2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide has a molecular weight of 241.29 g/mol, XLogP of -1.16, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[(5S)-5-amino-2-oxopiperidin-1-yl]-N-(oxetan-3-yl)propanamide is sourced from PubChem (CID 99981602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).