N-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide

C25H25NO2 — CID 175508225

IUPACN-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide
SMILESCc1cc(C(C)(C)C)cc(C(=O)c2ccccc2)c1NC(=O)c1ccccc1
InChIInChI=1S/C25H25NO2/c1-17-15-20(25(2,3)4)16-21(23(27)18-11-7-5-8-12-18)22(17)26-24(28)19-13-9-6-10-14-19/h5-16H,1-4H3,(H,26,28)
InChIKeyKIEDMOQJWLXAOH-UHFFFAOYSA-N
MW371.48 g/mol
LogP5.78
Rot. Bonds4

About N-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide

N-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide (PubChem CID 175508225) has the molecular formula C25H25NO2 and a molecular weight of 371.48 g/mol. Its IUPAC name is N-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide.

Molecular Properties

Compound NameN-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide
PubChem CID175508225
Molecular FormulaC25H25NO2
Molecular Weight371.48 g/mol
Exact Mass371.19
IUPAC NameN-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide
SMILESCc1cc(C(C)(C)C)cc(C(=O)c2ccccc2)c1NC(=O)c1ccccc1
InChIInChI=1S/C25H25NO2/c1-17-15-20(25(2,3)4)16-21(23(27)18-11-7-5-8-12-18)22(17)26-24(28)19-13-9-6-10-14-19/h5-16H,1-4H3,(H,26,28)
InChIKeyKIEDMOQJWLXAOH-UHFFFAOYSA-N
XLogP5.78
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.48
LogP ≤ 55.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-benzoyl-N-(2,4,6-trimethylphenyl)benzamide
CID 684747
N-(3-benzamido-2,4,6-trimethylphenyl)benzamide
CID 5084961
(5-tert-butyl-2-hydroxyphenyl)-phenylmethanone
CID 517837
2-benzoyl-4-tert-butylbenzoic acid
CID 3106283
4-tert-butyl-N-(2-methylphenyl)benzamide
CID 139185103
N-(3,5-ditert-butyl-2,6-dihydroxyphenyl)benzamide;N-(2,6-dihydroxyphenyl)benzamide
CID 158026912
[5-tert-butyl-2-(2,3,4-trimethylcyclopenta-2,4-dien-1-yl)phenyl]-phenylmethanone
CID 154426512
(2-tert-butyl-5-methylphenyl)-phenylmethanone
CID 58452150
N-(2,6-difluoro-3-methylphenyl)benzamide
CID 82819371
3-[[4-[1-[4-[(4-tert-butylbenzoyl)amino]-3,5-dimethylphenyl]cyclohexyl]-2,6-dimethylphenyl]carbamoyl]benzoic acid
CID 101075473
N-(2-benzoyl-6-chloro-1H-indol-3-yl)-4-tert-butylbenzamide
CID 18368116
N-(2,6-dimethyl-4-thiophen-2-ylphenyl)benzamide
CID 68907909

Frequently Asked Questions

What is the IUPAC name of N-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide?
The IUPAC name of N-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide (CID 175508225) is N-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide.
What is the SMILES notation for N-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide?
The canonical SMILES for N-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide is Cc1cc(C(C)(C)C)cc(C(=O)c2ccccc2)c1NC(=O)c1ccccc1.
What is the InChIKey of N-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide?
The InChIKey is KIEDMOQJWLXAOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25NO2/c1-17-15-20(25(2,3)4)16-21(23(27)18-11-7-5-8-12-18)22(17)26-24(28)19-13-9-6-10-14-19/h5-16H,1-4H3,(H,26,28).
What are the key properties of N-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide?
N-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide has a molecular weight of 371.48 g/mol, XLogP of 5.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzoyl-4-tert-butyl-6-methylphenyl)benzamide is sourced from PubChem (CID 175508225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).