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

C15H19FN2O2 — CID 70653963

IUPAC7-amino-2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one
SMILESNC1CC2(CCC1O)CCN(c1ccc(F)cc1)C2=O
InChIInChI=1S/C15H19FN2O2/c16-10-1-3-11(4-2-10)18-8-7-15(14(18)20)6-5-13(19)12(17)9-15/h1-4,12-13,19H,5-9,17H2
InChIKeyIXHUASKDUVITOW-UHFFFAOYSA-N
MW278.33 g/mol
LogP1.42
Rot. Bonds1

About 7-amino-2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one

7-amino-2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one (PubChem CID 70653963) has the molecular formula C15H19FN2O2 and a molecular weight of 278.33 g/mol. Its IUPAC name is 7-amino-2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name7-amino-2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one
PubChem CID70653963
Molecular FormulaC15H19FN2O2
Molecular Weight278.33 g/mol
Exact Mass278.14
IUPAC Name7-amino-2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one
SMILESNC1CC2(CCC1O)CCN(c1ccc(F)cc1)C2=O
InChIInChI=1S/C15H19FN2O2/c16-10-1-3-11(4-2-10)18-8-7-15(14(18)20)6-5-13(19)12(17)9-15/h1-4,12-13,19H,5-9,17H2
InChIKeyIXHUASKDUVITOW-UHFFFAOYSA-N
XLogP1.42
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-amino-2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one?
The IUPAC name of 7-amino-2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one (CID 70653963) is 7-amino-2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one.
What is the SMILES notation for 7-amino-2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one?
The canonical SMILES for 7-amino-2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one is NC1CC2(CCC1O)CCN(c1ccc(F)cc1)C2=O.
What is the InChIKey of 7-amino-2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one?
The InChIKey is IXHUASKDUVITOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O2/c16-10-1-3-11(4-2-10)18-8-7-15(14(18)20)6-5-13(19)12(17)9-15/h1-4,12-13,19H,5-9,17H2.
What are the key properties of 7-amino-2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one?
7-amino-2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one has a molecular weight of 278.33 g/mol, XLogP of 1.42, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-2-(4-fluorophenyl)-8-hydroxy-2-azaspiro[4.5]decan-1-one is sourced from PubChem (CID 70653963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).