1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid

C15H19N3O3 — CID 66835556

IUPAC1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid
SMILESO=C(O)N1CCC2(C=Cc3c(cnn3C3COC3)C2)CC1
InChIInChI=1S/C15H19N3O3/c19-14(20)17-5-3-15(4-6-17)2-1-13-11(7-15)8-16-18(13)12-9-21-10-12/h1-2,8,12H,3-7,9-10H2,(H,19,20)
InChIKeyMJODYAFMBPHPDP-UHFFFAOYSA-N
MW289.34 g/mol
LogP1.78
Rot. Bonds1

About 1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid

1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid (PubChem CID 66835556) has the molecular formula C15H19N3O3 and a molecular weight of 289.34 g/mol. Its IUPAC name is 1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid.

Molecular Properties

Compound Name1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid
PubChem CID66835556
Molecular FormulaC15H19N3O3
Molecular Weight289.34 g/mol
Exact Mass289.14
IUPAC Name1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid
SMILESO=C(O)N1CCC2(C=Cc3c(cnn3C3COC3)C2)CC1
InChIInChI=1S/C15H19N3O3/c19-14(20)17-5-3-15(4-6-17)2-1-13-11(7-15)8-16-18(13)12-9-21-10-12/h1-2,8,12H,3-7,9-10H2,(H,19,20)
InChIKeyMJODYAFMBPHPDP-UHFFFAOYSA-N
XLogP1.78
TPSA67.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(oxetan-3-yl)spiro[4H-indazole-5,4'-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 1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid?
The IUPAC name of 1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid (CID 66835556) is 1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid.
What is the SMILES notation for 1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid?
The canonical SMILES for 1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid is O=C(O)N1CCC2(C=Cc3c(cnn3C3COC3)C2)CC1.
What is the InChIKey of 1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid?
The InChIKey is MJODYAFMBPHPDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c19-14(20)17-5-3-15(4-6-17)2-1-13-11(7-15)8-16-18(13)12-9-21-10-12/h1-2,8,12H,3-7,9-10H2,(H,19,20).
What are the key properties of 1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid?
1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid has a molecular weight of 289.34 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxetan-3-yl)spiro[4H-indazole-5,4'-piperidine]-1'-carboxylic acid is sourced from PubChem (CID 66835556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).