2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione

C15H16FNO3 — CID 15657799

IUPAC2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione
SMILESO=C1CC2(CCCC2)C(=O)N1OCc1ccc(F)cc1
InChIInChI=1S/C15H16FNO3/c16-12-5-3-11(4-6-12)10-20-17-13(18)9-15(14(17)19)7-1-2-8-15/h3-6H,1-2,7-10H2
InChIKeyWZZRBGNRBHVKCZ-UHFFFAOYSA-N
MW277.29 g/mol
LogP2.58
Rot. Bonds3

About 2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione

2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione (PubChem CID 15657799) has the molecular formula C15H16FNO3 and a molecular weight of 277.29 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione.

Molecular Properties

Compound Name2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione
PubChem CID15657799
Molecular FormulaC15H16FNO3
Molecular Weight277.29 g/mol
Exact Mass277.11
IUPAC Name2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione
SMILESO=C1CC2(CCCC2)C(=O)N1OCc1ccc(F)cc1
InChIInChI=1S/C15H16FNO3/c16-12-5-3-11(4-6-12)10-20-17-13(18)9-15(14(17)19)7-1-2-8-15/h3-6H,1-2,7-10H2
InChIKeyWZZRBGNRBHVKCZ-UHFFFAOYSA-N
XLogP2.58
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.29
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione?
The IUPAC name of 2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione (CID 15657799) is 2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione.
What is the SMILES notation for 2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione?
The canonical SMILES for 2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione is O=C1CC2(CCCC2)C(=O)N1OCc1ccc(F)cc1.
What is the InChIKey of 2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione?
The InChIKey is WZZRBGNRBHVKCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO3/c16-12-5-3-11(4-6-12)10-20-17-13(18)9-15(14(17)19)7-1-2-8-15/h3-6H,1-2,7-10H2.
What are the key properties of 2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione?
2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione has a molecular weight of 277.29 g/mol, XLogP of 2.58, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)methoxy]-2-azaspiro[4.4]nonane-1,3-dione is sourced from PubChem (CID 15657799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).