N-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide

C15H17N3O3 — CID 109041036

IUPACN-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide
SMILESCC(=O)c1ccc(NC(=O)CCNc2cc(C)on2)cc1
InChIInChI=1S/C15H17N3O3/c1-10-9-14(18-21-10)16-8-7-15(20)17-13-5-3-12(4-6-13)11(2)19/h3-6,9H,7-8H2,1-2H3,(H,16,18)(H,17,20)
InChIKeyOJPXGVQIWLNVLQ-UHFFFAOYSA-N
MW287.32 g/mol
LogP2.63
Rot. Bonds6

About N-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide

N-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide (PubChem CID 109041036) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide
PubChem CID109041036
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC NameN-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide
SMILESCC(=O)c1ccc(NC(=O)CCNc2cc(C)on2)cc1
InChIInChI=1S/C15H17N3O3/c1-10-9-14(18-21-10)16-8-7-15(20)17-13-5-3-12(4-6-13)11(2)19/h3-6,9H,7-8H2,1-2H3,(H,16,18)(H,17,20)
InChIKeyOJPXGVQIWLNVLQ-UHFFFAOYSA-N
XLogP2.63
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4-[3-[(5-methyl-1,2-oxazol-3-yl)amino]propanoylamino]benzoate
CID 109041512
N-(3,4-dichlorophenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide
CID 109042633
N-(4-bromo-3-methylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide
CID 109042249
N-(3-chloro-4-fluorophenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide
CID 109038794
3-[(5-methyl-1,2-oxazol-3-yl)amino]-N-(4-phenylmethoxyphenyl)propanamide
CID 109042013
3-[acetyl-(5-methyl-1,2-oxazol-3-yl)amino]-N-(4-acetylphenyl)propanamide
CID 113135794
N-(2,6-dimethylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide
CID 109035848
3-(4-acetylanilino)-N-(4-fluorophenyl)propanamide
CID 109037659
N-(4-acetylphenyl)-3-(3,5-dichloroanilino)propanamide
CID 109041022
N-(2,6-difluorophenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide
CID 109042862
1-N-(4-acetylphenyl)-1-N'-(5-methyl-1,2-oxazol-3-yl)cyclopropane-1,1-dicarboxamide
CID 108983456
N-(4-fluorophenyl)-N'-(5-methyl-1,2-oxazol-3-yl)pentanediamide
CID 645214

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide?
The IUPAC name of N-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide (CID 109041036) is N-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide.
What is the SMILES notation for N-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide?
The canonical SMILES for N-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide is CC(=O)c1ccc(NC(=O)CCNc2cc(C)on2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide?
The InChIKey is OJPXGVQIWLNVLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-10-9-14(18-21-10)16-8-7-15(20)17-13-5-3-12(4-6-13)11(2)19/h3-6,9H,7-8H2,1-2H3,(H,16,18)(H,17,20).
What are the key properties of N-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide?
N-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide has a molecular weight of 287.32 g/mol, XLogP of 2.63, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide is sourced from PubChem (CID 109041036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).