N,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline

C22H23N — CID 134561199

IUPACN,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline
SMILESCc1cc(C)c(N(C)c2ccc(-c3ccccc3)cc2)cc1C
InChIInChI=1S/C22H23N/c1-16-14-18(3)22(15-17(16)2)23(4)21-12-10-20(11-13-21)19-8-6-5-7-9-19/h5-15H,1-4H3
InChIKeyWUUKBDOMZIPWNA-UHFFFAOYSA-N
MW301.43 g/mol
LogP6.05
Rot. Bonds3

About N,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline

N,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline (PubChem CID 134561199) has the molecular formula C22H23N and a molecular weight of 301.43 g/mol. Its IUPAC name is N,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline.

Molecular Properties

Compound NameN,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline
PubChem CID134561199
Molecular FormulaC22H23N
Molecular Weight301.43 g/mol
Exact Mass301.18
IUPAC NameN,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline
SMILESCc1cc(C)c(N(C)c2ccc(-c3ccccc3)cc2)cc1C
InChIInChI=1S/C22H23N/c1-16-14-18(3)22(15-17(16)2)23(4)21-12-10-20(11-13-21)19-8-6-5-7-9-19/h5-15H,1-4H3
InChIKeyWUUKBDOMZIPWNA-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-methyl-N-[4-(4-methylphenyl)phenyl]-4-phenylaniline
CID 143685330
N,2,4,6-tetramethyl-N-(4-phenylphenyl)aniline
CID 145100467
N-methyl-N-phenylaniline;N-methyl-4-phenyl-N-(4-phenylphenyl)aniline
CID 157333767
2-methyl-4-phenyl-N,N-bis(4-phenylphenyl)aniline
CID 90277832
N-methyl-4-[3-(4-methylphenyl)phenyl]-N-phenylaniline
CID 58151391
N,2-dimethyl-4-[3-methyl-4-(N-(4-methylphenyl)anilino)phenyl]-N-phenylaniline
CID 58038455
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
1-N,4-N-bis(3,4-dimethylphenyl)-1-N,4-N-bis(4-phenylphenyl)benzene-1,4-diamine
CID 59470459
N,2-dimethyl-N-[4-(4-naphthalen-2-ylphenyl)phenyl]aniline
CID 142481987
N-methyl-N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 70877197
N-methyl-N,2-bis(4-phenylphenyl)aniline;propane
CID 145370298
2-methyl-4-[3-methyl-4-(4-methyl-N-(4-phenylphenyl)anilino)phenyl]-N,N-bis(4-methylphenyl)aniline
CID 71277286

Frequently Asked Questions

What is the IUPAC name of N,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline?
The IUPAC name of N,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline (CID 134561199) is N,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline.
What is the SMILES notation for N,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline?
The canonical SMILES for N,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline is Cc1cc(C)c(N(C)c2ccc(-c3ccccc3)cc2)cc1C.
What is the InChIKey of N,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline?
The InChIKey is WUUKBDOMZIPWNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N/c1-16-14-18(3)22(15-17(16)2)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,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline?
N,2,4,5-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,2,4,5-tetramethyl-N-(4-phenylphenyl)aniline is sourced from PubChem (CID 134561199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).