N-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide

C19H22N2O2 — CID 51179788

IUPACN-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide
SMILESCc1cc(C)cc(NC(=O)c2ccc(NC(=O)C(C)C)cc2)c1
InChIInChI=1S/C19H22N2O2/c1-12(2)18(22)20-16-7-5-15(6-8-16)19(23)21-17-10-13(3)9-14(4)11-17/h5-12H,1-4H3,(H,20,22)(H,21,23)
InChIKeyJEYGEDLIPQXDTB-UHFFFAOYSA-N
MW310.40 g/mol
LogP4.15
Rot. Bonds4

About N-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide

N-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide (PubChem CID 51179788) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide
PubChem CID51179788
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide
SMILESCc1cc(C)cc(NC(=O)c2ccc(NC(=O)C(C)C)cc2)c1
InChIInChI=1S/C19H22N2O2/c1-12(2)18(22)20-16-7-5-15(6-8-16)19(23)21-17-10-13(3)9-14(4)11-17/h5-12H,1-4H3,(H,20,22)(H,21,23)
InChIKeyJEYGEDLIPQXDTB-UHFFFAOYSA-N
XLogP4.15
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide 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

1-N,4-N-bis[4-(2-methylpropanoylamino)phenyl]benzene-1,4-dicarboxamide
CID 17188207
4-bromo-N-[4-(2-methylpropanoylamino)phenyl]benzamide
CID 42120723
N-(3,5-dimethylphenyl)-4-(2-ethylbutanoylamino)benzamide
CID 17309070
4-[[4-(2-methylpropanoylamino)benzoyl]amino]benzoic acid
CID 17172328
3,4-dimethyl-N-[4-(2-methylpropanoylamino)phenyl]benzamide
CID 893199
4-N-(3,5-dimethylphenyl)-1-N-(4-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049661
N-(4-tert-butylphenyl)-4-(2-methylpropanoylamino)benzamide
CID 39088297
4-(carbamoylamino)-N-(3,5-dimethylphenyl)benzamide
CID 26016677
N-[4-(2-methylpropanoylamino)phenyl]-4-(propan-2-ylcarbamoylamino)benzamide
CID 55824637
ethyl 4-[[4-(2-methylpropanoylamino)benzoyl]amino]benzoate
CID 5236390
N-(4-cyanophenyl)-4-(2-methylpropanoylamino)benzamide
CID 977438
N-[4-(hydrazinecarbonyl)phenyl]-2-methylpropanamide
CID 952336

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide?
The IUPAC name of N-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide (CID 51179788) is N-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide is Cc1cc(C)cc(NC(=O)c2ccc(NC(=O)C(C)C)cc2)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide?
The InChIKey is JEYGEDLIPQXDTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-12(2)18(22)20-16-7-5-15(6-8-16)19(23)21-17-10-13(3)9-14(4)11-17/h5-12H,1-4H3,(H,20,22)(H,21,23).
What are the key properties of N-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide?
N-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide has a molecular weight of 310.40 g/mol, XLogP of 4.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide is sourced from PubChem (CID 51179788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).