3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide

C19H24N2O — CID 109035764

IUPAC3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide
SMILESCc1cccc(C)c1NCCC(=O)Nc1c(C)cccc1C
InChIInChI=1S/C19H24N2O/c1-13-7-5-8-14(2)18(13)20-12-11-17(22)21-19-15(3)9-6-10-16(19)4/h5-10,20H,11-12H2,1-4H3,(H,21,22)
InChIKeyRBQXCWRELJYRBL-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.36
Rot. Bonds5

About 3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide

3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide (PubChem CID 109035764) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is 3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide.

Molecular Properties

Compound Name3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide
PubChem CID109035764
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide
SMILESCc1cccc(C)c1NCCC(=O)Nc1c(C)cccc1C
InChIInChI=1S/C19H24N2O/c1-13-7-5-8-14(2)18(13)20-12-11-17(22)21-19-15(3)9-6-10-16(19)4/h5-10,20H,11-12H2,1-4H3,(H,21,22)
InChIKeyRBQXCWRELJYRBL-UHFFFAOYSA-N
XLogP4.36
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,6-dichloroanilino)-N-(2,6-dimethylphenyl)propanamide
CID 109035835
3-(2,6-dimethylanilino)-N-(2,3-dimethylphenyl)propanamide
CID 109035849
N-tert-butyl-3-(2,6-dimethylanilino)propanamide
CID 109031328
N-[3-(2,6-dimethylanilino)-3-oxopropyl]-2,2-dimethylpropanamide
CID 18155095
N-(3,5-dichlorophenyl)-3-(2,6-dimethylanilino)propanamide
CID 109035918
N-(2,6-dimethylphenyl)-3-hydroxypropanamide
CID 82112001
N-(2,6-dimethylphenyl)-3-(propylamino)propanamide
CID 59981693
N-(2,6-dimethylphenyl)-3-(propan-2-ylamino)propanamide
CID 54924858
N'-(2,6-dimethylphenyl)-N-propylbutanediamide
CID 71979821
N-(2,6-dimethylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide
CID 109035848
N-(4-chloro-2-methylphenyl)-3-(2,6-dimethylanilino)propanamide
CID 109035866
3-(4-bromo-3-methylanilino)-N-(2,6-dimethylphenyl)propanamide
CID 109035823

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide?
The IUPAC name of 3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide (CID 109035764) is 3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide.
What is the SMILES notation for 3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide?
The canonical SMILES for 3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide is Cc1cccc(C)c1NCCC(=O)Nc1c(C)cccc1C.
What is the InChIKey of 3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide?
The InChIKey is RBQXCWRELJYRBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-13-7-5-8-14(2)18(13)20-12-11-17(22)21-19-15(3)9-6-10-16(19)4/h5-10,20H,11-12H2,1-4H3,(H,21,22).
What are the key properties of 3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide?
3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide has a molecular weight of 296.41 g/mol, XLogP of 4.36, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-dimethylanilino)-N-(2,6-dimethylphenyl)propanamide is sourced from PubChem (CID 109035764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).