N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline

C22H23N — CID 145100467

IUPACN,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline
SMILESCc1cc(C)c(N(C)c2ccc(-c3ccccc3)cc2)c(C)c1
InChIInChI=1S/C22H23N/c1-16-14-17(2)22(18(3)15-16)23(4)21-12-10-20(11-13-21)19-8-6-5-7-9-19/h5-15H,1-4H3
InChIKeyIVJZTOZXWCPFMV-UHFFFAOYSA-N
MW301.43 g/mol
LogP6.05
Rot. Bonds3

About N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline

N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline (PubChem CID 145100467) has the molecular formula C22H23N and a molecular weight of 301.43 g/mol. Its IUPAC name is N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline.

Molecular Properties

Compound NameN,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline
PubChem CID145100467
Molecular FormulaC22H23N
Molecular Weight301.43 g/mol
Exact Mass301.18
IUPAC NameN,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline
SMILESCc1cc(C)c(N(C)c2ccc(-c3ccccc3)cc2)c(C)c1
InChIInChI=1S/C22H23N/c1-16-14-17(2)22(18(3)15-16)23(4)21-12-10-20(11-13-21)19-8-6-5-7-9-19/h5-15H,1-4H3
InChIKeyIVJZTOZXWCPFMV-UHFFFAOYSA-N
XLogP6.05
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500301.43
LogP ≤ 56.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,2,3,4,5,6-hexamethyl-N-phenylaniline;N,2,3,4,5,6-hexamethyl-N-(4-phenylphenyl)aniline;N-methyl-N,4-diphenylaniline;N,2,4,6-tetramethyl-N-phenylaniline;N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline
CID 160738204
N-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline
CID 143685330
5-methyl-1-N,3-N-bis(4-phenylphenyl)-1-N,3-N-bis(2,4,6-trimethylphenyl)benzene-1,3-diamine
CID 118415243
N-methyl-N-phenylaniline;1-methyl-4-(4-phenylphenyl)benzene;1-methyl-4-[4-(4-phenylphenyl)phenyl]benzene;1-methyl-4-[4-[4-(4-phenylphenyl)phenyl]phenyl]benzene
CID 157193805
N-methyl-4-[3-(4-methylphenyl)phenyl]-N-phenylaniline
CID 58151391
N-methyl-N-phenylaniline;N-methyl-4-phenyl-N-(4-phenylphenyl)aniline
CID 157333767
N,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline
CID 134561199
4-N,4-N-bis(3,5-dimethylphenyl)-1-N-[4-(N-(3,5-dimethylphenyl)-3,5-dimethylanilino)phenyl]-1-N-(4-phenylphenyl)benzene-1,4-diamine
CID 22964147
benzene;N,4-dimethyl-N-phenylaniline
CID 71196716
2,4,6-trimethyl-N-(4-methylphenyl)-N-[4-[4-[4-[4-[4-[4-[4-[4-(4-methyl-N-(2,4,6-trimethylphenyl)anilino)phenyl]-N-(2,4,6-trimethylphenyl)anilino]phenyl]-N-(2,4,6-trimethylphenyl)anilino]phenyl]-N-(2,4,6-trimethylphenyl)anilino]phenyl]phenyl]aniline
CID 90265211
4-methyl-N-[4-[4-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 19604781
N,4-dimethyl-N-phenylaniline;ethane;toluene
CID 143203824

Frequently Asked Questions

What is the IUPAC name of N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline?
The IUPAC name of N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline (CID 145100467) is N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline.
What is the SMILES notation for N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline?
The canonical SMILES for N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline is Cc1cc(C)c(N(C)c2ccc(-c3ccccc3)cc2)c(C)c1.
What is the InChIKey of N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline?
The InChIKey is IVJZTOZXWCPFMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N/c1-16-14-17(2)22(18(3)15-16)23(4)21-12-10-20(11-13-21)19-8-6-5-7-9-19/h5-15H,1-4H3.
What are the key properties of N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline?
N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline has a molecular weight of 301.43 g/mol, XLogP of 6.05, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline is sourced from PubChem (CID 145100467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).