8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane

C20H23NO2 — CID 14460961

IUPAC8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane
SMILESCN1CCC2(CC1)COC(c1ccccc1)(c1ccccc1)O2
InChIInChI=1S/C20H23NO2/c1-21-14-12-19(13-15-21)16-22-20(23-19,17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11H,12-16H2,1H3
InChIKeyYXSZRXSHHDVYKU-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.40
Rot. Bonds2

About 8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane

8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane (PubChem CID 14460961) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is 8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane
PubChem CID14460961
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Name8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane
SMILESCN1CCC2(CC1)COC(c1ccccc1)(c1ccccc1)O2
InChIInChI=1S/C20H23NO2/c1-21-14-12-19(13-15-21)16-22-20(23-19,17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11H,12-16H2,1H3
InChIKeyYXSZRXSHHDVYKU-UHFFFAOYSA-N
XLogP3.40
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane?
The IUPAC name of 8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane (CID 14460961) is 8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane?
The canonical SMILES for 8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane is CN1CCC2(CC1)COC(c1ccccc1)(c1ccccc1)O2.
What is the InChIKey of 8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane?
The InChIKey is YXSZRXSHHDVYKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/c1-21-14-12-19(13-15-21)16-22-20(23-19,17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11H,12-16H2,1H3.
What are the key properties of 8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane?
8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane has a molecular weight of 309.41 g/mol, XLogP of 3.40, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2,2-diphenyl-1,3-dioxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 14460961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).