4-[(dimethylamino)methyl]-2,6-diphenylphenol

C21H21NO — CID 15625757

IUPAC4-[(dimethylamino)methyl]-2,6-diphenylphenol
SMILESCN(C)Cc1cc(-c2ccccc2)c(O)c(-c2ccccc2)c1
InChIInChI=1S/C21H21NO/c1-22(2)15-16-13-19(17-9-5-3-6-10-17)21(23)20(14-16)18-11-7-4-8-12-18/h3-14,23H,15H2,1-2H3
InChIKeyRXXGPXQJRRGRJP-UHFFFAOYSA-N
MW303.41 g/mol
LogP4.79
Rot. Bonds4

About 4-[(dimethylamino)methyl]-2,6-diphenylphenol

4-[(dimethylamino)methyl]-2,6-diphenylphenol (PubChem CID 15625757) has the molecular formula C21H21NO and a molecular weight of 303.41 g/mol. Its IUPAC name is 4-[(dimethylamino)methyl]-2,6-diphenylphenol.

Molecular Properties

Compound Name4-[(dimethylamino)methyl]-2,6-diphenylphenol
PubChem CID15625757
Molecular FormulaC21H21NO
Molecular Weight303.41 g/mol
Exact Mass303.16
IUPAC Name4-[(dimethylamino)methyl]-2,6-diphenylphenol
SMILESCN(C)Cc1cc(-c2ccccc2)c(O)c(-c2ccccc2)c1
InChIInChI=1S/C21H21NO/c1-22(2)15-16-13-19(17-9-5-3-6-10-17)21(23)20(14-16)18-11-7-4-8-12-18/h3-14,23H,15H2,1-2H3
InChIKeyRXXGPXQJRRGRJP-UHFFFAOYSA-N
XLogP4.79
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-[(dimethylamino)methyl]-4-phenyl-1,3-dihydroisoindole-2-carbonitrile
CID 130430596
benzene;N,N-dimethyl-1-phenylmethanamine;ethane
CID 90785154
N,N-dimethyl-1-phenylmethanamine;hydrobromide
CID 71398520
N,N-dimethyl-1-phenylmethanamine;phosphane
CID 174524909
N,N-dimethyl-1-phenylmethanamine;tetrahydrochloride
CID 172854351
4-[(dimethylamino)methyl]-2,6-difluorophenol
CID 82977010
4-bromo-2,6-diphenylphenol
CID 11147454
2,4,6-tris[(dimethylamino)methyl]phenol
CID 7026
carbonic acid;N,N-dimethyl-1-phenylmethanamine
CID 69138278
4-[1-(4-hydroxy-3,5-diphenylphenyl)ethyl]-2,6-diphenylphenol
CID 139825093
2,6-diphenyl-4-propan-2-ylphenol
CID 155045328
4-[5-(4-hydroxy-3-methyl-5-phenylphenyl)pentyl]-2-methyl-6-phenylphenol
CID 19003377

Frequently Asked Questions

What is the IUPAC name of 4-[(dimethylamino)methyl]-2,6-diphenylphenol?
The IUPAC name of 4-[(dimethylamino)methyl]-2,6-diphenylphenol (CID 15625757) is 4-[(dimethylamino)methyl]-2,6-diphenylphenol.
What is the SMILES notation for 4-[(dimethylamino)methyl]-2,6-diphenylphenol?
The canonical SMILES for 4-[(dimethylamino)methyl]-2,6-diphenylphenol is CN(C)Cc1cc(-c2ccccc2)c(O)c(-c2ccccc2)c1.
What is the InChIKey of 4-[(dimethylamino)methyl]-2,6-diphenylphenol?
The InChIKey is RXXGPXQJRRGRJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO/c1-22(2)15-16-13-19(17-9-5-3-6-10-17)21(23)20(14-16)18-11-7-4-8-12-18/h3-14,23H,15H2,1-2H3.
What are the key properties of 4-[(dimethylamino)methyl]-2,6-diphenylphenol?
4-[(dimethylamino)methyl]-2,6-diphenylphenol has a molecular weight of 303.41 g/mol, XLogP of 4.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(dimethylamino)methyl]-2,6-diphenylphenol is sourced from PubChem (CID 15625757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).