(5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane

C20H24N2 — CID 3232734

IUPAC(5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane
SMILESc1ccc(-c2cccc(N3CC[C@@]4(CCCNC4)C3)c2)cc1
InChIInChI=1S/C20H24N2/c1-2-6-17(7-3-1)18-8-4-9-19(14-18)22-13-11-20(16-22)10-5-12-21-15-20/h1-4,6-9,14,21H,5,10-13,15-16H2/t20-/m1/s1
InChIKeyGMBJJMHTWIGFPH-HXUWFJFHSA-N
MW292.43 g/mol
LogP3.93
Rot. Bonds2

About (5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane

(5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane (PubChem CID 3232734) has the molecular formula C20H24N2 and a molecular weight of 292.43 g/mol. Its IUPAC name is (5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name(5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane
PubChem CID3232734
Molecular FormulaC20H24N2
Molecular Weight292.43 g/mol
Exact Mass292.19
IUPAC Name(5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane
SMILESc1ccc(-c2cccc(N3CC[C@@]4(CCCNC4)C3)c2)cc1
InChIInChI=1S/C20H24N2/c1-2-6-17(7-3-1)18-8-4-9-19(14-18)22-13-11-20(16-22)10-5-12-21-15-20/h1-4,6-9,14,21H,5,10-13,15-16H2/t20-/m1/s1
InChIKeyGMBJJMHTWIGFPH-HXUWFJFHSA-N
XLogP3.93
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane?
The IUPAC name of (5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane (CID 3232734) is (5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane.
What is the SMILES notation for (5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane?
The canonical SMILES for (5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane is c1ccc(-c2cccc(N3CC[C@@]4(CCCNC4)C3)c2)cc1.
What is the InChIKey of (5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane?
The InChIKey is GMBJJMHTWIGFPH-HXUWFJFHSA-N. The full InChI is InChI=1S/C20H24N2/c1-2-6-17(7-3-1)18-8-4-9-19(14-18)22-13-11-20(16-22)10-5-12-21-15-20/h1-4,6-9,14,21H,5,10-13,15-16H2/t20-/m1/s1.
What are the key properties of (5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane?
(5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane has a molecular weight of 292.43 g/mol, XLogP of 3.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-2-(3-phenylphenyl)-2,9-diazaspiro[4.5]decane is sourced from PubChem (CID 3232734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).