(5S,6S)-6-phenyl-1-azaspiro[4.5]decane

C15H21N — CID 97356341

IUPAC(5S,6S)-6-phenyl-1-azaspiro[4.5]decane
SMILESc1ccc([C@@H]2CCCC[C@]23CCCN3)cc1
InChIInChI=1S/C15H21N/c1-2-7-13(8-3-1)14-9-4-5-10-15(14)11-6-12-16-15/h1-3,7-8,14,16H,4-6,9-12H2/t14-,15-/m0/s1
InChIKeyUOVPTGPDKNPQRJ-GJZGRUSLSA-N
MW215.34 g/mol
LogP3.47
Rot. Bonds1

About (5S,6S)-6-phenyl-1-azaspiro[4.5]decane

(5S,6S)-6-phenyl-1-azaspiro[4.5]decane (PubChem CID 97356341) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is (5S,6S)-6-phenyl-1-azaspiro[4.5]decane.

Molecular Properties

Compound Name(5S,6S)-6-phenyl-1-azaspiro[4.5]decane
PubChem CID97356341
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name(5S,6S)-6-phenyl-1-azaspiro[4.5]decane
SMILESc1ccc([C@@H]2CCCC[C@]23CCCN3)cc1
InChIInChI=1S/C15H21N/c1-2-7-13(8-3-1)14-9-4-5-10-15(14)11-6-12-16-15/h1-3,7-8,14,16H,4-6,9-12H2/t14-,15-/m0/s1
InChIKeyUOVPTGPDKNPQRJ-GJZGRUSLSA-N
XLogP3.47
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (5S,6S)-6-phenyl-1-azaspiro[4.5]decane?
The IUPAC name of (5S,6S)-6-phenyl-1-azaspiro[4.5]decane (CID 97356341) is (5S,6S)-6-phenyl-1-azaspiro[4.5]decane.
What is the SMILES notation for (5S,6S)-6-phenyl-1-azaspiro[4.5]decane?
The canonical SMILES for (5S,6S)-6-phenyl-1-azaspiro[4.5]decane is c1ccc([C@@H]2CCCC[C@]23CCCN3)cc1.
What is the InChIKey of (5S,6S)-6-phenyl-1-azaspiro[4.5]decane?
The InChIKey is UOVPTGPDKNPQRJ-GJZGRUSLSA-N. The full InChI is InChI=1S/C15H21N/c1-2-7-13(8-3-1)14-9-4-5-10-15(14)11-6-12-16-15/h1-3,7-8,14,16H,4-6,9-12H2/t14-,15-/m0/s1.
What are the key properties of (5S,6S)-6-phenyl-1-azaspiro[4.5]decane?
(5S,6S)-6-phenyl-1-azaspiro[4.5]decane has a molecular weight of 215.34 g/mol, XLogP of 3.47, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5S,6S)-6-phenyl-1-azaspiro[4.5]decane is sourced from PubChem (CID 97356341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).