3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide

C15H15Cl2N3O3 — CID 113134153

IUPAC3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide
SMILESCC(=O)N(CCC(=O)Nc1cc(C)on1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H15Cl2N3O3/c1-9-5-14(19-23-9)18-15(22)3-4-20(10(2)21)13-7-11(16)6-12(17)8-13/h5-8H,3-4H2,1-2H3,(H,18,19,22)
InChIKeyMVTKJKDLZTUTFE-UHFFFAOYSA-N
MW356.21 g/mol
LogP3.67
Rot. Bonds5

About 3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide

3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide (PubChem CID 113134153) has the molecular formula C15H15Cl2N3O3 and a molecular weight of 356.21 g/mol. Its IUPAC name is 3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide.

Molecular Properties

Compound Name3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide
PubChem CID113134153
Molecular FormulaC15H15Cl2N3O3
Molecular Weight356.21 g/mol
Exact Mass355.05
IUPAC Name3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide
SMILESCC(=O)N(CCC(=O)Nc1cc(C)on1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H15Cl2N3O3/c1-9-5-14(19-23-9)18-15(22)3-4-20(10(2)21)13-7-11(16)6-12(17)8-13/h5-8H,3-4H2,1-2H3,(H,18,19,22)
InChIKeyMVTKJKDLZTUTFE-UHFFFAOYSA-N
XLogP3.67
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.21
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide 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-[acetyl-(5-methyl-1,2-oxazol-3-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 113135846
ethyl 4-[acetyl-[3-[(5-methyl-1,2-oxazol-3-yl)amino]-3-oxopropyl]amino]benzoate
CID 113133389
3-(N-acetyl-3,5-dichloroanilino)-N-phenylpropanamide
CID 113134105
2-(3,5-dichloro-N-methylsulfonylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 113156926
3-(N-acetyl-3,5-dichloroanilino)-N-(4-propan-2-ylphenyl)propanamide
CID 113134123
3-(N-acetyl-2-methoxy-5-methylanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 113129681
3-[acetyl(2-methylpropyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 113116105
3-(N-acetyl-3,5-dichloroanilino)-N-(2-methylpropyl)propanamide
CID 113134052
3-[acetyl(prop-2-enyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 113115709
ethyl 2-[acetyl-[3-[(5-methyl-1,2-oxazol-3-yl)amino]-3-oxopropyl]amino]benzoate
CID 113134650
2-[carboxymethyl-[3-[(5-methyl-1,2-oxazol-3-yl)amino]-3-oxopropyl]amino]acetic acid
CID 63645461
3-(N-acetyl-3,5-dichloroanilino)-N-cyclopentylpropanamide
CID 113134055

Frequently Asked Questions

What is the IUPAC name of 3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide?
The IUPAC name of 3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide (CID 113134153) is 3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide.
What is the SMILES notation for 3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide?
The canonical SMILES for 3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide is CC(=O)N(CCC(=O)Nc1cc(C)on1)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide?
The InChIKey is MVTKJKDLZTUTFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2N3O3/c1-9-5-14(19-23-9)18-15(22)3-4-20(10(2)21)13-7-11(16)6-12(17)8-13/h5-8H,3-4H2,1-2H3,(H,18,19,22).
What are the key properties of 3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide?
3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide has a molecular weight of 356.21 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(N-acetyl-3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)propanamide is sourced from PubChem (CID 113134153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).