methyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate

C15H20N2O4 — CID 43431194

IUPACmethyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate
SMILESCOC(=O)C1CCN(C(=O)CCn2ccccc2=O)CC1
InChIInChI=1S/C15H20N2O4/c1-21-15(20)12-5-9-17(10-6-12)14(19)7-11-16-8-3-2-4-13(16)18/h2-4,8,12H,5-7,9-11H2,1H3
InChIKeyNOCJANONUZZTBP-UHFFFAOYSA-N
MW292.33 g/mol
LogP0.65
Rot. Bonds4

About methyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate

methyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate (PubChem CID 43431194) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is methyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate.

Molecular Properties

Compound Namemethyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate
PubChem CID43431194
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC Namemethyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate
SMILESCOC(=O)C1CCN(C(=O)CCn2ccccc2=O)CC1
InChIInChI=1S/C15H20N2O4/c1-21-15(20)12-5-9-17(10-6-12)14(19)7-11-16-8-3-2-4-13(16)18/h2-4,8,12H,5-7,9-11H2,1H3
InChIKeyNOCJANONUZZTBP-UHFFFAOYSA-N
XLogP0.65
TPSA68.61 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze methyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate with MolForge

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

Launch Full Analysis

Related Compounds

CID 133959664
CID 133959664
CID 6211682
CID 6211682
CID 142547801
CID 142547801
CID 4777976
CID 4777976
CID 29854902
CID 29854902
CID 39151151
CID 39151151
CID 43170476
CID 43170476
CID 43354232
CID 43354232
CID 43404263
CID 43404263
CID 43404840
CID 43404840
CID 43406877
CID 43406877
CID 43409071
CID 43409071

Frequently Asked Questions

What is the IUPAC name of methyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate?
The IUPAC name of methyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate (CID 43431194) is methyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate.
What is the SMILES notation for methyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate?
The canonical SMILES for methyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate is COC(=O)C1CCN(C(=O)CCn2ccccc2=O)CC1.
What is the InChIKey of methyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate?
The InChIKey is NOCJANONUZZTBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-21-15(20)12-5-9-17(10-6-12)14(19)7-11-16-8-3-2-4-13(16)18/h2-4,8,12H,5-7,9-11H2,1H3.
What are the key properties of methyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate?
methyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate has a molecular weight of 292.33 g/mol, XLogP of 0.65, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 1-[3-(2-oxo-1-pyridinyl)propanoyl]piperidine-4-carboxylate is sourced from PubChem (CID 43431194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).