8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile

C24H22N2O2 — CID 10893984

IUPAC8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile
SMILESCC1(C)COC2(C=C(c3ccccc3)C(c3ccccc3)C2(C#N)C#N)OC1
InChIInChI=1S/C24H22N2O2/c1-22(2)16-27-24(28-17-22)13-20(18-9-5-3-6-10-18)21(23(24,14-25)15-26)19-11-7-4-8-12-19/h3-13,21H,16-17H2,1-2H3
InChIKeyMEZCIEQAVRHNCS-UHFFFAOYSA-N
MW370.45 g/mol
LogP4.67
Rot. Bonds2

About 8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile

8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile (PubChem CID 10893984) has the molecular formula C24H22N2O2 and a molecular weight of 370.45 g/mol. Its IUPAC name is 8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile.

Molecular Properties

Compound Name8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile
PubChem CID10893984
Molecular FormulaC24H22N2O2
Molecular Weight370.45 g/mol
Exact Mass370.17
IUPAC Name8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile
SMILESCC1(C)COC2(C=C(c3ccccc3)C(c3ccccc3)C2(C#N)C#N)OC1
InChIInChI=1S/C24H22N2O2/c1-22(2)16-27-24(28-17-22)13-20(18-9-5-3-6-10-18)21(23(24,14-25)15-26)19-11-7-4-8-12-19/h3-13,21H,16-17H2,1-2H3
InChIKeyMEZCIEQAVRHNCS-UHFFFAOYSA-N
XLogP4.67
TPSA66.04 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-ethenyl-4-methyl-2-phenyloxolane-3,3-dicarbonitrile
CID 10752411
1-methyl-4-phenyl-1,4-dihydronaphthalene-2,2,3,3-tetracarbonitrile
CID 135036038
(3'S,3'aS)-5,5-dimethylspiro[1,3-dioxane-2,2'-3a,4-dihydro-3H-cyclopenta[a]indene]-3'-carbonitrile
CID 139114495
(4R)-5,5-dimethyl-2-oxido-3,4-diphenyl-4H-1,2-oxazol-2-ium
CID 124802079
(3S,4'S)-2-oxo-2',4'-diphenylspiro[1H-indole-3,6'-4,7-dihydro-1-benzofuran]-5',5'-dicarbonitrile
CID 102142441
1-methyl-4-oxo-2,6-diphenylcyclohexane-1-carbonitrile
CID 69303844
(1R,6R)-1-methyl-6-phenylcyclohex-3-ene-1-carbonitrile
CID 135037492
(1S,4R,7S,10R)-6-phenyltricyclo[5.2.1.04,10]deca-5,8-diene-2,2,3,3-tetracarbonitrile
CID 94037159
6-phenyltricyclo[5.2.1.04,10]deca-5,8-diene-2,2,3,3-tetracarbonitrile
CID 90482330
(1R,4S,7S,10S)-6-phenyltricyclo[5.2.1.04,10]deca-5,8-diene-2,2,3,3-tetracarbonitrile
CID 100896101
2-(4-phenylphenyl)cyclopropane-1,1-dicarbonitrile
CID 156779666
2,2-dimethyl-1,3-diphenyl-1,3-dihydroindene
CID 20781734

Frequently Asked Questions

What is the IUPAC name of 8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile?
The IUPAC name of 8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile (CID 10893984) is 8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile.
What is the SMILES notation for 8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile?
The canonical SMILES for 8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile is CC1(C)COC2(C=C(c3ccccc3)C(c3ccccc3)C2(C#N)C#N)OC1.
What is the InChIKey of 8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile?
The InChIKey is MEZCIEQAVRHNCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O2/c1-22(2)16-27-24(28-17-22)13-20(18-9-5-3-6-10-18)21(23(24,14-25)15-26)19-11-7-4-8-12-19/h3-13,21H,16-17H2,1-2H3.
What are the key properties of 8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile?
8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile has a molecular weight of 370.45 g/mol, XLogP of 4.67, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8-dimethyl-2,3-diphenyl-6,10-dioxaspiro[4.5]dec-1-ene-4,4-dicarbonitrile is sourced from PubChem (CID 10893984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).