N-(2-ethylbutyl)-2,6-dimethylbenzamide

C15H23NO — CID 103714285

IUPACN-(2-ethylbutyl)-2,6-dimethylbenzamide
SMILESCCC(CC)CNC(=O)c1c(C)cccc1C
InChIInChI=1S/C15H23NO/c1-5-13(6-2)10-16-15(17)14-11(3)8-7-9-12(14)4/h7-9,13H,5-6,10H2,1-4H3,(H,16,17)
InChIKeyWRZUDMODLYHDMM-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.47
Rot. Bonds5

About N-(2-ethylbutyl)-2,6-dimethylbenzamide

N-(2-ethylbutyl)-2,6-dimethylbenzamide (PubChem CID 103714285) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is N-(2-ethylbutyl)-2,6-dimethylbenzamide.

Molecular Properties

Compound NameN-(2-ethylbutyl)-2,6-dimethylbenzamide
PubChem CID103714285
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC NameN-(2-ethylbutyl)-2,6-dimethylbenzamide
SMILESCCC(CC)CNC(=O)c1c(C)cccc1C
InChIInChI=1S/C15H23NO/c1-5-13(6-2)10-16-15(17)14-11(3)8-7-9-12(14)4/h7-9,13H,5-6,10H2,1-4H3,(H,16,17)
InChIKeyWRZUDMODLYHDMM-UHFFFAOYSA-N
XLogP3.47
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(2-ethylbutyl)-2,6-dimethylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-ethylbutyl)-2,6-dihydroxybenzamide
CID 103890450
N-(3-ethyl-2-hydroxypentyl)-2,6-dimethylbenzamide
CID 103770620
2-amino-N-(2-ethylhexyl)-6-methylbenzamide
CID 107819599
N-(3-amino-2-hydroxy-3-oxopropyl)-2,6-dimethylbenzamide
CID 114152583
N-(2-ethylbutyl)-6-methylpyridine-2-carboxamide
CID 115612957
N-(3-aminopentyl)-2,6-dimethylbenzamide
CID 114026646
2-[[(2,6-dimethylbenzoyl)amino]methyl]-4-methylpentanoic acid
CID 103925730
2-(2,6-dimethylphenoxy)-N-(2-ethylbutyl)acetamide
CID 115612647
N-(4-bromo-2-ethylbutyl)-2,6-dihydroxybenzamide
CID 107691145
N-(2-ethylbutyl)-2-hydroxybenzamide
CID 115613562
3-[[(2,6-dichlorobenzoyl)amino]methyl]pentanoic acid
CID 81066303
3-[[(2-methylbenzoyl)amino]methyl]pentanoic acid
CID 81065631

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylbutyl)-2,6-dimethylbenzamide?
The IUPAC name of N-(2-ethylbutyl)-2,6-dimethylbenzamide (CID 103714285) is N-(2-ethylbutyl)-2,6-dimethylbenzamide.
What is the SMILES notation for N-(2-ethylbutyl)-2,6-dimethylbenzamide?
The canonical SMILES for N-(2-ethylbutyl)-2,6-dimethylbenzamide is CCC(CC)CNC(=O)c1c(C)cccc1C.
What is the InChIKey of N-(2-ethylbutyl)-2,6-dimethylbenzamide?
The InChIKey is WRZUDMODLYHDMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-5-13(6-2)10-16-15(17)14-11(3)8-7-9-12(14)4/h7-9,13H,5-6,10H2,1-4H3,(H,16,17).
What are the key properties of N-(2-ethylbutyl)-2,6-dimethylbenzamide?
N-(2-ethylbutyl)-2,6-dimethylbenzamide has a molecular weight of 233.35 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylbutyl)-2,6-dimethylbenzamide is sourced from PubChem (CID 103714285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).