2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid

C14H16N2O3 — CID 68828702

IUPAC2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid
SMILESO=C1CC2(CCN(C(=O)O)CC2)c2ccccc2N1
InChIInChI=1S/C14H16N2O3/c17-12-9-14(5-7-16(8-6-14)13(18)19)10-3-1-2-4-11(10)15-12/h1-4H,5-9H2,(H,15,17)(H,18,19)
InChIKeyODCHUCAIGLRSNH-UHFFFAOYSA-N
MW260.29 g/mol
LogP2.04
Rot. Bonds

About 2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid

2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid (PubChem CID 68828702) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is 2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid.

Molecular Properties

Compound Name2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid
PubChem CID68828702
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid
SMILESO=C1CC2(CCN(C(=O)O)CC2)c2ccccc2N1
InChIInChI=1S/C14H16N2O3/c17-12-9-14(5-7-16(8-6-14)13(18)19)10-3-1-2-4-11(10)15-12/h1-4H,5-9H2,(H,15,17)(H,18,19)
InChIKeyODCHUCAIGLRSNH-UHFFFAOYSA-N
XLogP2.04
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid 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 2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid?
The IUPAC name of 2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid (CID 68828702) is 2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid.
What is the SMILES notation for 2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid?
The canonical SMILES for 2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid is O=C1CC2(CCN(C(=O)O)CC2)c2ccccc2N1.
What is the InChIKey of 2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid?
The InChIKey is ODCHUCAIGLRSNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c17-12-9-14(5-7-16(8-6-14)13(18)19)10-3-1-2-4-11(10)15-12/h1-4H,5-9H2,(H,15,17)(H,18,19).
What are the key properties of 2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid?
2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid has a molecular weight of 260.29 g/mol, XLogP of 2.04, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxospiro[1,3-dihydroquinoline-4,4'-piperidine]-1'-carboxylic acid is sourced from PubChem (CID 68828702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).