N-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide

C24H25NO — CID 133200142

IUPACN-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide
SMILESCc1ccc(C(NC(=O)c2cc(C)ccc2C)c2ccccc2)c(C)c1
InChIInChI=1S/C24H25NO/c1-16-11-13-21(19(4)14-16)23(20-8-6-5-7-9-20)25-24(26)22-15-17(2)10-12-18(22)3/h5-15,23H,1-4H3,(H,25,26)
InChIKeyQLANIEAKEYKJSE-UHFFFAOYSA-N
MW343.47 g/mol
LogP5.44
Rot. Bonds4

About N-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide

N-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide (PubChem CID 133200142) has the molecular formula C24H25NO and a molecular weight of 343.47 g/mol. Its IUPAC name is N-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide.

Molecular Properties

Compound NameN-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide
PubChem CID133200142
Molecular FormulaC24H25NO
Molecular Weight343.47 g/mol
Exact Mass343.19
IUPAC NameN-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide
SMILESCc1ccc(C(NC(=O)c2cc(C)ccc2C)c2ccccc2)c(C)c1
InChIInChI=1S/C24H25NO/c1-16-11-13-21(19(4)14-16)23(20-8-6-5-7-9-20)25-24(26)22-15-17(2)10-12-18(22)3/h5-15,23H,1-4H3,(H,25,26)
InChIKeyQLANIEAKEYKJSE-UHFFFAOYSA-N
XLogP5.44
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.47
LogP ≤ 55.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,5-dimethyl-N-[(R)-(4-methylphenyl)-phenylmethyl]benzamide
CID 100743905
2-methyl-N-[(R)-(2-methylphenyl)-phenylmethyl]benzamide
CID 28578946
N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-2-methylbenzamide
CID 28633869
2,5-dimethyl-N-[(1S)-1-(2-methylphenyl)ethyl]benzamide
CID 31178331
N-benzhydryl-2-methyl-5-methylsulfonylbenzamide
CID 27254371
N-benzhydryl-2,4,5-trimethylbenzamide
CID 100710488
N-[1-(2-aminophenyl)ethyl]-2,5-dimethylbenzamide
CID 43297799
N-[(1S)-1-(2-methoxyphenyl)ethyl]-2,5-dimethylbenzamide
CID 2473869
N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-2-ethylsulfanylbenzamide
CID 99132067
N-[(S)-(2,4-dimethylphenyl)-phenylmethyl]methanesulfonamide
CID 95706524
N-(2-hydroxy-2-phenylethyl)-2,5-dimethylbenzamide
CID 43391272
N-[3H-benzimidazol-5-yl(phenyl)methyl]-2,4-dimethylbenzamide
CID 78836794

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide?
The IUPAC name of N-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide (CID 133200142) is N-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide.
What is the SMILES notation for N-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide?
The canonical SMILES for N-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide is Cc1ccc(C(NC(=O)c2cc(C)ccc2C)c2ccccc2)c(C)c1.
What is the InChIKey of N-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide?
The InChIKey is QLANIEAKEYKJSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO/c1-16-11-13-21(19(4)14-16)23(20-8-6-5-7-9-20)25-24(26)22-15-17(2)10-12-18(22)3/h5-15,23H,1-4H3,(H,25,26).
What are the key properties of N-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide?
N-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide has a molecular weight of 343.47 g/mol, XLogP of 5.44, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dimethylphenyl)-phenylmethyl]-2,5-dimethylbenzamide is sourced from PubChem (CID 133200142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).