3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide

C14H22N2O — CID 65234113

IUPAC3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide
SMILESCCNC(C)(CC(N)=O)c1ccc(C)cc1C
InChIInChI=1S/C14H22N2O/c1-5-16-14(4,9-13(15)17)12-7-6-10(2)8-11(12)3/h6-8,16H,5,9H2,1-4H3,(H2,15,17)
InChIKeyMNYBFUKBQLLUBS-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.00
Rot. Bonds5

About 3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide

3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide (PubChem CID 65234113) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide.

Molecular Properties

Compound Name3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide
PubChem CID65234113
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide
SMILESCCNC(C)(CC(N)=O)c1ccc(C)cc1C
InChIInChI=1S/C14H22N2O/c1-5-16-14(4,9-13(15)17)12-7-6-10(2)8-11(12)3/h6-8,16H,5,9H2,1-4H3,(H2,15,17)
InChIKeyMNYBFUKBQLLUBS-UHFFFAOYSA-N
XLogP2.00
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide 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

3-(2,4-dimethylphenyl)-3-(ethylamino)butan-1-ol
CID 65235048
3-(2,5-dimethylphenyl)-3-(propylamino)butanamide
CID 65235843
3-(2,5-dimethylphenyl)-3-(methylamino)butanamide
CID 65236175
3-(2,4-dimethylphenyl)-3-methylbutan-2-one;ethane;propan-1-ol
CID 143994165
3-[(2,4-dimethylphenyl)methylamino]-3-methylbutanamide
CID 106095989
3-(ethylamino)-3-(4-methylphenyl)butanoic acid
CID 65236813
ethyl 3-amino-3-(2,4-dimethylphenyl)butanoate
CID 79848686
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(ethylamino)butanamide
CID 65233837
3-(ethylamino)-3-[3-(trifluoromethyl)phenyl]butanamide
CID 65234342
ethyl 2-(2,5-dimethylphenyl)-2-methylpropanoate
CID 62550626
ethyl 3-(2,4-difluorophenyl)-3-(ethylamino)butanoate
CID 65233544
[2-(2,4-dimethylphenyl)-2-methylpropyl]carbamic acid
CID 115171380

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide?
The IUPAC name of 3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide (CID 65234113) is 3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide.
What is the SMILES notation for 3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide?
The canonical SMILES for 3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide is CCNC(C)(CC(N)=O)c1ccc(C)cc1C.
What is the InChIKey of 3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide?
The InChIKey is MNYBFUKBQLLUBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-5-16-14(4,9-13(15)17)12-7-6-10(2)8-11(12)3/h6-8,16H,5,9H2,1-4H3,(H2,15,17).
What are the key properties of 3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide?
3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide has a molecular weight of 234.34 g/mol, XLogP of 2.00, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dimethylphenyl)-3-(ethylamino)butanamide is sourced from PubChem (CID 65234113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).