[4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone

C24H25NO — CID 59551612

IUPAC[4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone
SMILESCc1ccc(CNc2ccc(C(=O)c3cc(C)c(C)c(C)c3)cc2)cc1
InChIInChI=1S/C24H25NO/c1-16-5-7-20(8-6-16)15-25-23-11-9-21(10-12-23)24(26)22-13-17(2)19(4)18(3)14-22/h5-14,25H,15H2,1-4H3
InChIKeyMWOSXGNTJHMESW-UHFFFAOYSA-N
MW343.47 g/mol
LogP5.76
Rot. Bonds5

About [4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone

[4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone (PubChem CID 59551612) has the molecular formula C24H25NO and a molecular weight of 343.47 g/mol. Its IUPAC name is [4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone.

Molecular Properties

Compound Name[4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone
PubChem CID59551612
Molecular FormulaC24H25NO
Molecular Weight343.47 g/mol
Exact Mass343.19
IUPAC Name[4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone
SMILESCc1ccc(CNc2ccc(C(=O)c3cc(C)c(C)c(C)c3)cc2)cc1
InChIInChI=1S/C24H25NO/c1-16-5-7-20(8-6-16)15-25-23-11-9-21(10-12-23)24(26)22-13-17(2)19(4)18(3)14-22/h5-14,25H,15H2,1-4H3
InChIKeyMWOSXGNTJHMESW-UHFFFAOYSA-N
XLogP5.76
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.47
LogP ≤ 55.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-N-[[4-[(4-methylanilino)methyl]phenyl]methyl]aniline
CID 3313778
[4-(benzylamino)phenyl]-phenylmethanone
CID 11208443
N-methyl-2-[4-[(4-methylphenyl)methylamino]phenyl]acetamide
CID 43713951
2-methyl-4-[(4-methylphenyl)methylamino]benzenecarbothioamide
CID 81278781
5-[4-(benzylamino)benzoyl]-2-methylbenzamide
CID 177024781
2,6-dimethyl-4-[(4-methylanilino)methyl]phenol
CID 28932362
2-[4-[(4-methylanilino)methyl]phenyl]propanoic acid
CID 103234862
N-[(4-iodophenyl)methyl]-4-methylaniline
CID 60674684
4-[(4-methylphenyl)methylamino]benzaldehyde
CID 89270360
N-[4-[(4-methylphenyl)methylamino]phenyl]-1,3-benzodioxole-5-carboxamide
CID 112982174
4-methyl-N-[4-[(3-methylphenyl)methylamino]phenyl]benzamide
CID 112982081
4-[(3,4-dimethylanilino)methyl]-N-methylbenzamide
CID 60961314

Frequently Asked Questions

What is the IUPAC name of [4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone?
The IUPAC name of [4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone (CID 59551612) is [4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone.
What is the SMILES notation for [4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone?
The canonical SMILES for [4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone is Cc1ccc(CNc2ccc(C(=O)c3cc(C)c(C)c(C)c3)cc2)cc1.
What is the InChIKey of [4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone?
The InChIKey is MWOSXGNTJHMESW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO/c1-16-5-7-20(8-6-16)15-25-23-11-9-21(10-12-23)24(26)22-13-17(2)19(4)18(3)14-22/h5-14,25H,15H2,1-4H3.
What are the key properties of [4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone?
[4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone has a molecular weight of 343.47 g/mol, XLogP of 5.76, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(4-methylphenyl)methylamino]phenyl]-(3,4,5-trimethylphenyl)methanone is sourced from PubChem (CID 59551612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).