N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide

C18H17N3O3 — CID 39912338

IUPACN-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide
SMILESCc1cc(NC(=O)CNc2ccc(Oc3ccccc3)cc2)no1
InChIInChI=1S/C18H17N3O3/c1-13-11-17(21-24-13)20-18(22)12-19-14-7-9-16(10-8-14)23-15-5-3-2-4-6-15/h2-11,19H,12H2,1H3,(H,20,21,22)
InChIKeyLXSCZJQATTVCGT-UHFFFAOYSA-N
MW323.35 g/mol
LogP3.83
Rot. Bonds6

About N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide

N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide (PubChem CID 39912338) has the molecular formula C18H17N3O3 and a molecular weight of 323.35 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide
PubChem CID39912338
Molecular FormulaC18H17N3O3
Molecular Weight323.35 g/mol
Exact Mass323.13
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide
SMILESCc1cc(NC(=O)CNc2ccc(Oc3ccccc3)cc2)no1
InChIInChI=1S/C18H17N3O3/c1-13-11-17(21-24-13)20-18(22)12-19-14-7-9-16(10-8-14)23-15-5-3-2-4-6-15/h2-11,19H,12H2,1H3,(H,20,21,22)
InChIKeyLXSCZJQATTVCGT-UHFFFAOYSA-N
XLogP3.83
TPSA76.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(5-methyl-1,2-oxazol-3-yl)-N-(4-phenoxyphenyl)acetamide
CID 110425586
N-(4-methoxyphenyl)-4-[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]benzamide
CID 37475742
N-(3-acetamidophenyl)-2-(4-phenoxyanilino)acetamide
CID 54812613
2-[4-(diethylamino)anilino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 109010414
N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide
CID 109009860
N-(5-methyl-1,2-oxazol-3-yl)-6-(4-phenoxyanilino)pyridazine-3-carboxamide
CID 109130085
2-(3-chloro-4-methylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 51178299
phenyl N-(5-methyl-1,2-oxazol-3-yl)carbamate
CID 4519264
2-(3-cyclopentyloxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 37231455
N-(1,3-benzodioxol-5-yl)-2-(4-phenoxyanilino)acetamide
CID 109010719
N-[4-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanylphenyl]-2-phenoxyacetamide
CID 19630696
N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)pyrimidine-4-carboxamide
CID 109318464

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide (CID 39912338) is N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide is Cc1cc(NC(=O)CNc2ccc(Oc3ccccc3)cc2)no1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide?
The InChIKey is LXSCZJQATTVCGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3/c1-13-11-17(21-24-13)20-18(22)12-19-14-7-9-16(10-8-14)23-15-5-3-2-4-6-15/h2-11,19H,12H2,1H3,(H,20,21,22).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide?
N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide has a molecular weight of 323.35 g/mol, XLogP of 3.83, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide is sourced from PubChem (CID 39912338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).