2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one

C15H18FNO2 — CID 122672476

IUPAC2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one
SMILESO=C1N(c2ccc(F)cc2)CCC12CCC(O)CC2
InChIInChI=1S/C15H18FNO2/c16-11-1-3-12(4-2-11)17-10-9-15(14(17)19)7-5-13(18)6-8-15/h1-4,13,18H,5-10H2
InChIKeyBAGANCXIMUCNDQ-UHFFFAOYSA-N
MW263.31 g/mol
LogP2.48
Rot. Bonds1

About 2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one

2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one (PubChem CID 122672476) has the molecular formula C15H18FNO2 and a molecular weight of 263.31 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one
PubChem CID122672476
Molecular FormulaC15H18FNO2
Molecular Weight263.31 g/mol
Exact Mass263.13
IUPAC Name2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one
SMILESO=C1N(c2ccc(F)cc2)CCC12CCC(O)CC2
InChIInChI=1S/C15H18FNO2/c16-11-1-3-12(4-2-11)17-10-9-15(14(17)19)7-5-13(18)6-8-15/h1-4,13,18H,5-10H2
InChIKeyBAGANCXIMUCNDQ-UHFFFAOYSA-N
XLogP2.48
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.31
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one?
The IUPAC name of 2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one (CID 122672476) is 2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one.
What is the SMILES notation for 2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one?
The canonical SMILES for 2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one is O=C1N(c2ccc(F)cc2)CCC12CCC(O)CC2.
What is the InChIKey of 2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one?
The InChIKey is BAGANCXIMUCNDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FNO2/c16-11-1-3-12(4-2-11)17-10-9-15(14(17)19)7-5-13(18)6-8-15/h1-4,13,18H,5-10H2.
What are the key properties of 2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one?
2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one has a molecular weight of 263.31 g/mol, XLogP of 2.48, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one is sourced from PubChem (CID 122672476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).