5-(2,2-diphenylethyl)-3,3-dimethylmorpholine

C20H25NO — CID 10357167

IUPAC5-(2,2-diphenylethyl)-3,3-dimethylmorpholine
SMILESCC1(C)COCC(CC(c2ccccc2)c2ccccc2)N1
InChIInChI=1S/C20H25NO/c1-20(2)15-22-14-18(21-20)13-19(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,18-19,21H,13-15H2,1-2H3
InChIKeyXPVHEVDWXHDCHQ-UHFFFAOYSA-N
MW295.43 g/mol
LogP3.98
Rot. Bonds4

About 5-(2,2-diphenylethyl)-3,3-dimethylmorpholine

5-(2,2-diphenylethyl)-3,3-dimethylmorpholine (PubChem CID 10357167) has the molecular formula C20H25NO and a molecular weight of 295.43 g/mol. Its IUPAC name is 5-(2,2-diphenylethyl)-3,3-dimethylmorpholine.

Molecular Properties

Compound Name5-(2,2-diphenylethyl)-3,3-dimethylmorpholine
PubChem CID10357167
Molecular FormulaC20H25NO
Molecular Weight295.43 g/mol
Exact Mass295.19
IUPAC Name5-(2,2-diphenylethyl)-3,3-dimethylmorpholine
SMILESCC1(C)COCC(CC(c2ccccc2)c2ccccc2)N1
InChIInChI=1S/C20H25NO/c1-20(2)15-22-14-18(21-20)13-19(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,18-19,21H,13-15H2,1-2H3
InChIKeyXPVHEVDWXHDCHQ-UHFFFAOYSA-N
XLogP3.98
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2,2-diphenylethyl)-3,3-dimethylmorpholine?
The IUPAC name of 5-(2,2-diphenylethyl)-3,3-dimethylmorpholine (CID 10357167) is 5-(2,2-diphenylethyl)-3,3-dimethylmorpholine.
What is the SMILES notation for 5-(2,2-diphenylethyl)-3,3-dimethylmorpholine?
The canonical SMILES for 5-(2,2-diphenylethyl)-3,3-dimethylmorpholine is CC1(C)COCC(CC(c2ccccc2)c2ccccc2)N1.
What is the InChIKey of 5-(2,2-diphenylethyl)-3,3-dimethylmorpholine?
The InChIKey is XPVHEVDWXHDCHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO/c1-20(2)15-22-14-18(21-20)13-19(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,18-19,21H,13-15H2,1-2H3.
What are the key properties of 5-(2,2-diphenylethyl)-3,3-dimethylmorpholine?
5-(2,2-diphenylethyl)-3,3-dimethylmorpholine has a molecular weight of 295.43 g/mol, XLogP of 3.98, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,2-diphenylethyl)-3,3-dimethylmorpholine is sourced from PubChem (CID 10357167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).