2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione

C15H25NO3 — CID 10563768

IUPAC2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione
SMILESO=C1CC2(CCCCCCCCCCC2)C(=O)N1O
InChIInChI=1S/C15H25NO3/c17-13-12-15(14(18)16(13)19)10-8-6-4-2-1-3-5-7-9-11-15/h19H,1-12H2
InChIKeyMUSIFXCKZSHTDJ-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.43
Rot. Bonds

About 2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione

2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione (PubChem CID 10563768) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione.

Molecular Properties

Compound Name2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione
PubChem CID10563768
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC Name2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione
SMILESO=C1CC2(CCCCCCCCCCC2)C(=O)N1O
InChIInChI=1S/C15H25NO3/c17-13-12-15(14(18)16(13)19)10-8-6-4-2-1-3-5-7-9-11-15/h19H,1-12H2
InChIKeyMUSIFXCKZSHTDJ-UHFFFAOYSA-N
XLogP3.43
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione?
The IUPAC name of 2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione (CID 10563768) is 2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione.
What is the SMILES notation for 2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione?
The canonical SMILES for 2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione is O=C1CC2(CCCCCCCCCCC2)C(=O)N1O.
What is the InChIKey of 2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione?
The InChIKey is MUSIFXCKZSHTDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c17-13-12-15(14(18)16(13)19)10-8-6-4-2-1-3-5-7-9-11-15/h19H,1-12H2.
What are the key properties of 2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione?
2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione has a molecular weight of 267.37 g/mol, XLogP of 3.43, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione is sourced from PubChem (CID 10563768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).