2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine

C20H25NO — CID 29254

IUPAC2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine
SMILESCN(C)CCOC1c2ccccc2C(C)(C)c2ccccc21
InChIInChI=1S/C20H25NO/c1-20(2)17-11-7-5-9-15(17)19(22-14-13-21(3)4)16-10-6-8-12-18(16)20/h5-12,19H,13-14H2,1-4H3
InChIKeyVTELBPXZMLGAMU-UHFFFAOYSA-N
MW295.43 g/mol
LogP3.99
Rot. Bonds4

About 2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine

2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine (PubChem CID 29254) has the molecular formula C20H25NO and a molecular weight of 295.43 g/mol. Its IUPAC name is 2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine
PubChem CID29254
Molecular FormulaC20H25NO
Molecular Weight295.43 g/mol
Exact Mass295.19
IUPAC Name2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine
SMILESCN(C)CCOC1c2ccccc2C(C)(C)c2ccccc21
InChIInChI=1S/C20H25NO/c1-20(2)17-11-7-5-9-15(17)19(22-14-13-21(3)4)16-10-6-8-12-18(16)20/h5-12,19H,13-14H2,1-4H3
InChIKeyVTELBPXZMLGAMU-UHFFFAOYSA-N
XLogP3.99
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine?
The IUPAC name of 2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine (CID 29254) is 2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine.
What is the SMILES notation for 2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine?
The canonical SMILES for 2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine is CN(C)CCOC1c2ccccc2C(C)(C)c2ccccc21.
What is the InChIKey of 2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine?
The InChIKey is VTELBPXZMLGAMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO/c1-20(2)17-11-7-5-9-15(17)19(22-14-13-21(3)4)16-10-6-8-12-18(16)20/h5-12,19H,13-14H2,1-4H3.
What are the key properties of 2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine?
2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine has a molecular weight of 295.43 g/mol, XLogP of 3.99, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(10,10-dimethyl-9H-anthracen-9-yl)oxy]-N,N-dimethylethanamine is sourced from PubChem (CID 29254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).