4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide

C13H18N2O3 — CID 47307868

IUPAC4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide
SMILESCNC(=O)c1ccc(NC(=O)C(C)OC)c(C)c1
InChIInChI=1S/C13H18N2O3/c1-8-7-10(13(17)14-3)5-6-11(8)15-12(16)9(2)18-4/h5-7,9H,1-4H3,(H,14,17)(H,15,16)
InChIKeyABSLSVYWNOAWTJ-UHFFFAOYSA-N
MW250.30 g/mol
LogP1.33
Rot. Bonds4

About 4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide

4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide (PubChem CID 47307868) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is 4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide.

Molecular Properties

Compound Name4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide
PubChem CID47307868
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide
SMILESCNC(=O)c1ccc(NC(=O)C(C)OC)c(C)c1
InChIInChI=1S/C13H18N2O3/c1-8-7-10(13(17)14-3)5-6-11(8)15-12(16)9(2)18-4/h5-7,9H,1-4H3,(H,14,17)(H,15,16)
InChIKeyABSLSVYWNOAWTJ-UHFFFAOYSA-N
XLogP1.33
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(2-methoxypropanoylamino)-N,3-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-[4-(dimethylamino)-2-methylphenyl]-2-methoxypropanamide
CID 47308010
4-(4-hydroxypentanoylamino)-N,3-dimethylbenzamide
CID 79204777
4-(2,2-dimethylpropanoylamino)-N,3-dimethylbenzamide
CID 61215739
4-[[(2R)-1-(tert-butylamino)-1-oxopropan-2-yl]carbamoylamino]-N,3-dimethylbenzamide
CID 95296510
N-(4-ethoxy-2-methylphenyl)-2-methoxypropanamide
CID 47312187
4-[[(2S)-2-aminopropanoyl]amino]-3-methyl-N-propan-2-ylbenzamide;hydrochloride
CID 119300417
N-cyclopropyl-3-(2-methoxypropanoylamino)-4-methylbenzamide
CID 47308191
4-(butanoylamino)-N,3-dimethylbenzamide
CID 61216786
2-(2-methoxypropanoylamino)-N-methylbenzamide
CID 47302363
3-[2-(4-chloro-2-methylphenoxy)propanoylamino]-4-methoxy-N-methylbenzamide
CID 87001794
4-[2-methyl-4-(methylcarbamoyl)anilino]-4-oxobutanoic acid
CID 54868212
3-[2-(4-chloro-3-methylphenoxy)propanoylamino]-4-methoxy-N-methylbenzamide
CID 87025364

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide?
The IUPAC name of 4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide (CID 47307868) is 4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide.
What is the SMILES notation for 4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide?
The canonical SMILES for 4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide is CNC(=O)c1ccc(NC(=O)C(C)OC)c(C)c1.
What is the InChIKey of 4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide?
The InChIKey is ABSLSVYWNOAWTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-8-7-10(13(17)14-3)5-6-11(8)15-12(16)9(2)18-4/h5-7,9H,1-4H3,(H,14,17)(H,15,16).
What are the key properties of 4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide?
4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide has a molecular weight of 250.30 g/mol, XLogP of 1.33, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxypropanoylamino)-N,3-dimethylbenzamide is sourced from PubChem (CID 47307868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).