1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one

C18H28N2O3 — CID 91912865

IUPAC1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one
SMILESO=C(C1CCC1)N1CCC(N2C(=O)C(O)C23CCCCC3)CC1
InChIInChI=1S/C18H28N2O3/c21-15-17(23)20(18(15)9-2-1-3-10-18)14-7-11-19(12-8-14)16(22)13-5-4-6-13/h13-15,21H,1-12H2
InChIKeyNGLABCRJVNMICG-UHFFFAOYSA-N
MW320.43 g/mol
LogP1.68
Rot. Bonds2

About 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one

1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one (PubChem CID 91912865) has the molecular formula C18H28N2O3 and a molecular weight of 320.43 g/mol. Its IUPAC name is 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one.

Molecular Properties

Compound Name1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one
PubChem CID91912865
Molecular FormulaC18H28N2O3
Molecular Weight320.43 g/mol
Exact Mass320.21
IUPAC Name1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one
SMILESO=C(C1CCC1)N1CCC(N2C(=O)C(O)C23CCCCC3)CC1
InChIInChI=1S/C18H28N2O3/c21-15-17(23)20(18(15)9-2-1-3-10-18)14-7-11-19(12-8-14)16(22)13-5-4-6-13/h13-15,21H,1-12H2
InChIKeyNGLABCRJVNMICG-UHFFFAOYSA-N
XLogP1.68
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.43
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one 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-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one?
The IUPAC name of 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one (CID 91912865) is 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one.
What is the SMILES notation for 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one?
The canonical SMILES for 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one is O=C(C1CCC1)N1CCC(N2C(=O)C(O)C23CCCCC3)CC1.
What is the InChIKey of 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one?
The InChIKey is NGLABCRJVNMICG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O3/c21-15-17(23)20(18(15)9-2-1-3-10-18)14-7-11-19(12-8-14)16(22)13-5-4-6-13/h13-15,21H,1-12H2.
What are the key properties of 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one?
1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one has a molecular weight of 320.43 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(cyclobutanecarbonyl)piperidin-4-yl]-3-hydroxy-1-azaspiro[3.5]nonan-2-one is sourced from PubChem (CID 91912865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).