N-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide

C23H27NO2 — CID 793898

IUPACN-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide
SMILESCc1cc(C)c(C(=O)c2ccc(C(=O)NC3CCCCC3)cc2)c(C)c1
InChIInChI=1S/C23H27NO2/c1-15-13-16(2)21(17(3)14-15)22(25)18-9-11-19(12-10-18)23(26)24-20-7-5-4-6-8-20/h9-14,20H,4-8H2,1-3H3,(H,24,26)
InChIKeyGAWQHFUSYUKMLU-UHFFFAOYSA-N
MW349.47 g/mol
LogP4.91
Rot. Bonds4

About N-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide

N-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide (PubChem CID 793898) has the molecular formula C23H27NO2 and a molecular weight of 349.47 g/mol. Its IUPAC name is N-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide.

Molecular Properties

Compound NameN-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide
PubChem CID793898
Molecular FormulaC23H27NO2
Molecular Weight349.47 g/mol
Exact Mass349.20
IUPAC NameN-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide
SMILESCc1cc(C)c(C(=O)c2ccc(C(=O)NC3CCCCC3)cc2)c(C)c1
InChIInChI=1S/C23H27NO2/c1-15-13-16(2)21(17(3)14-15)22(25)18-9-11-19(12-10-18)23(26)24-20-7-5-4-6-8-20/h9-14,20H,4-8H2,1-3H3,(H,24,26)
InChIKeyGAWQHFUSYUKMLU-UHFFFAOYSA-N
XLogP4.91
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.47
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclooctyl-4-methylbenzamide
CID 3995245
N-cyclobutyl-4-methylbenzamide
CID 23530676
N-cyclododecyl-2,4-dimethylbenzamide
CID 19656258
4-amino-N-cyclohexyl-3-methylbenzamide
CID 16773559
N-cyclohexyl-4-hydroxy-3-methylbenzamide
CID 113355938
N-cyclohexyl-4-[(2,4-dimethylphenyl)carbamoylamino]benzamide
CID 17180897
N-cyclohexyl-5-methylcyclodeca-1,3,5,7,9-pentaene-1-carboxamide
CID 171081015
N-cyclooctyl-3-methylbenzamide
CID 966011
N-cycloheptyl-4-(methylamino)benzamide
CID 62165627
N-cyclobutyl-3,4-dimethylbenzamide;ethane
CID 142916267
4-bromo-N-cyclopentyl-3-methylbenzamide
CID 46738751
3-amino-N-cyclohexyl-5-methylbenzamide
CID 113396098

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide?
The IUPAC name of N-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide (CID 793898) is N-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide.
What is the SMILES notation for N-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide?
The canonical SMILES for N-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide is Cc1cc(C)c(C(=O)c2ccc(C(=O)NC3CCCCC3)cc2)c(C)c1.
What is the InChIKey of N-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide?
The InChIKey is GAWQHFUSYUKMLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27NO2/c1-15-13-16(2)21(17(3)14-15)22(25)18-9-11-19(12-10-18)23(26)24-20-7-5-4-6-8-20/h9-14,20H,4-8H2,1-3H3,(H,24,26).
What are the key properties of N-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide?
N-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide has a molecular weight of 349.47 g/mol, XLogP of 4.91, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-(2,4,6-trimethylbenzoyl)benzamide is sourced from PubChem (CID 793898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).