3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide

C14H16N4O3 — CID 167779651

IUPAC3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide
SMILESCc1cc(NC(=O)CNc2ccc(C(N)=O)cc2C)no1
InChIInChI=1S/C14H16N4O3/c1-8-5-10(14(15)20)3-4-11(8)16-7-13(19)17-12-6-9(2)21-18-12/h3-6,16H,7H2,1-2H3,(H2,15,20)(H,17,18,19)
InChIKeyVMRNKUCLWQWFEW-UHFFFAOYSA-N
MW288.31 g/mol
LogP1.44
Rot. Bonds5

About 3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide

3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide (PubChem CID 167779651) has the molecular formula C14H16N4O3 and a molecular weight of 288.31 g/mol. Its IUPAC name is 3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide.

Molecular Properties

Compound Name3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide
PubChem CID167779651
Molecular FormulaC14H16N4O3
Molecular Weight288.31 g/mol
Exact Mass288.12
IUPAC Name3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide
SMILESCc1cc(NC(=O)CNc2ccc(C(N)=O)cc2C)no1
InChIInChI=1S/C14H16N4O3/c1-8-5-10(14(15)20)3-4-11(8)16-7-13(19)17-12-6-9(2)21-18-12/h3-6,16H,7H2,1-2H3,(H2,15,20)(H,17,18,19)
InChIKeyVMRNKUCLWQWFEW-UHFFFAOYSA-N
XLogP1.44
TPSA110.25 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 51.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]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

4-(2,2-dimethylpropylamino)-3-methylbenzamide
CID 61324735
3-methyl-4-(3-oxobutanoylamino)benzamide
CID 61251334
2-(3-chloro-4-methylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 51178299
2-(2,6-difluoroanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 109011324
4-[(5-bromothiophen-2-yl)methylamino]-3-methylbenzamide
CID 43706863
N-(2-bromophenyl)-2-[(5-methyl-1,2-oxazol-3-yl)amino]acetamide
CID 109010783
N-(4-methoxyphenyl)-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide
CID 37475742
4-[(5-benzyl-1,2-oxazol-3-yl)methylamino]-3-methylbenzamide
CID 166321411
4-(heptylamino)-3-methylbenzamide
CID 43706885
[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl] 2-[(4-tert-butylbenzoyl)amino]acetate
CID 7854411
ethyl 2-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]acetyl]amino]benzoate
CID 109011291
2-[4-(diethylamino)anilino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 109010414

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide?
The IUPAC name of 3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide (CID 167779651) is 3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide.
What is the SMILES notation for 3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide?
The canonical SMILES for 3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide is Cc1cc(NC(=O)CNc2ccc(C(N)=O)cc2C)no1.
What is the InChIKey of 3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide?
The InChIKey is VMRNKUCLWQWFEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3/c1-8-5-10(14(15)20)3-4-11(8)16-7-13(19)17-12-6-9(2)21-18-12/h3-6,16H,7H2,1-2H3,(H2,15,20)(H,17,18,19).
What are the key properties of 3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide?
3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide has a molecular weight of 288.31 g/mol, XLogP of 1.44, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide is sourced from PubChem (CID 167779651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).