(2,2-diphenyloxolan-3-yl)methyl-dimethylazanium

C19H24NO+ — CID 171736715

IUPAC(2,2-diphenyloxolan-3-yl)methyl-dimethylazanium
SMILESC[NH+](C)CC1CCOC1(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H23NO/c1-20(2)15-18-13-14-21-19(18,16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,18H,13-15H2,1-2H3/p+1
InChIKeyBOTHKNZTGGXFEQ-UHFFFAOYSA-O
MW282.41 g/mol
LogP2.11
Rot. Bonds4

About (2,2-diphenyloxolan-3-yl)methyl-dimethylazanium

(2,2-diphenyloxolan-3-yl)methyl-dimethylazanium (PubChem CID 171736715) has the molecular formula C19H24NO+ and a molecular weight of 282.41 g/mol. Its IUPAC name is (2,2-diphenyloxolan-3-yl)methyl-dimethylazanium.

Molecular Properties

Compound Name(2,2-diphenyloxolan-3-yl)methyl-dimethylazanium
PubChem CID171736715
Molecular FormulaC19H24NO+
Molecular Weight282.41 g/mol
Exact Mass282.19
IUPAC Name(2,2-diphenyloxolan-3-yl)methyl-dimethylazanium
SMILESC[NH+](C)CC1CCOC1(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H23NO/c1-20(2)15-18-13-14-21-19(18,16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,18H,13-15H2,1-2H3/p+1
InChIKeyBOTHKNZTGGXFEQ-UHFFFAOYSA-O
XLogP2.11
TPSA13.67 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2,2-diphenyloxolan-3-yl)methyl-dimethylazanium 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

[(3R)-2,2-diphenyloxolan-3-yl]methyl-hydroxy-dimethylazanium
CID 174262060
(3R)-2,2-diphenyloxolan-3-ol
CID 125490634
1-(2,2-diphenyloxolan-3-yl)ethanamine
CID 126485677
(2S,3R)-3-fluoro-2-[(2R,3S)-3-fluoro-2-phenyloxolan-2-yl]peroxy-2-phenyloxolane
CID 102315051
(2R,3R)-2-tert-butyl-3-iodo-2-phenyloxolane
CID 53242306
(3-hydroxy-3-phenyl-2H-1,4-benzodioxin-2-yl)methyl-dimethylazanium
CID 5005876
[(2R,3R)-3-hydroxy-3-phenyl-2H-1,4-benzodioxin-2-yl]methyl-dimethylazanium
CID 786433
[(1R,2R)-2-hydroxy-2-(3-hydroxyphenyl)cyclohexyl]methyl-dimethylazanium chloride
CID 122174016
2-ethoxy-2-phenyl-1,3-dioxane
CID 86143567
(4R)-5,5-diphenyl-4-propan-2-yl-4H-1,3-oxazole
CID 174626798
[2-methyl-2-(2-methylphenyl)oxolan-3-yl]methanamine
CID 105458006
3,4-dimethyl-2,2-diphenyloxetane
CID 14290990

Frequently Asked Questions

What is the IUPAC name of (2,2-diphenyloxolan-3-yl)methyl-dimethylazanium?
The IUPAC name of (2,2-diphenyloxolan-3-yl)methyl-dimethylazanium (CID 171736715) is (2,2-diphenyloxolan-3-yl)methyl-dimethylazanium.
What is the SMILES notation for (2,2-diphenyloxolan-3-yl)methyl-dimethylazanium?
The canonical SMILES for (2,2-diphenyloxolan-3-yl)methyl-dimethylazanium is C[NH+](C)CC1CCOC1(c1ccccc1)c1ccccc1.
What is the InChIKey of (2,2-diphenyloxolan-3-yl)methyl-dimethylazanium?
The InChIKey is BOTHKNZTGGXFEQ-UHFFFAOYSA-O. The full InChI is InChI=1S/C19H23NO/c1-20(2)15-18-13-14-21-19(18,16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,18H,13-15H2,1-2H3/p+1.
What are the key properties of (2,2-diphenyloxolan-3-yl)methyl-dimethylazanium?
(2,2-diphenyloxolan-3-yl)methyl-dimethylazanium has a molecular weight of 282.41 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-diphenyloxolan-3-yl)methyl-dimethylazanium is sourced from PubChem (CID 171736715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).