N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide

C18H23N3O3 — CID 112791855

IUPACN-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide
SMILESCCc1onc(C)c1C(=O)N(C)CC(=O)Nc1c(C)cccc1C
InChIInChI=1S/C18H23N3O3/c1-6-14-16(13(4)20-24-14)18(23)21(5)10-15(22)19-17-11(2)8-7-9-12(17)3/h7-9H,6,10H2,1-5H3,(H,19,22)
InChIKeyUZVRSQRBZZBPSJ-UHFFFAOYSA-N
MW329.40 g/mol
LogP2.87
Rot. Bonds5

About N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide

N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide (PubChem CID 112791855) has the molecular formula C18H23N3O3 and a molecular weight of 329.40 g/mol. Its IUPAC name is N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide
PubChem CID112791855
Molecular FormulaC18H23N3O3
Molecular Weight329.40 g/mol
Exact Mass329.17
IUPAC NameN-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide
SMILESCCc1onc(C)c1C(=O)N(C)CC(=O)Nc1c(C)cccc1C
InChIInChI=1S/C18H23N3O3/c1-6-14-16(13(4)20-24-14)18(23)21(5)10-15(22)19-17-11(2)8-7-9-12(17)3/h7-9H,6,10H2,1-5H3,(H,19,22)
InChIKeyUZVRSQRBZZBPSJ-UHFFFAOYSA-N
XLogP2.87
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide 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

2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N-(2,6-dimethylphenyl)acetamide
CID 38302891
2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl-methylamino]-N-(2-ethyl-6-methylphenyl)acetamide
CID 27687567
2-bromo-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methylbenzamide
CID 8500775
cis-(1R,2S)-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N,2-dimethylcyclopropane-1-carboxamide
CID 2650123
3-(dimethylamino)-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methylbenzamide
CID 9431379
5-chloro-1-[(2-chlorophenyl)methyl]-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N,3-dimethylpyrazole-4-carboxamide
CID 31929455
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methylnaphthalene-2-carboxamide
CID 8500886
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methyl-4-(5-methylpyrazol-1-yl)benzamide
CID 9426110
2-chloro-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methylpyridine-4-carboxamide
CID 31936113
bis(2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide);dihydrochloride
CID 69335483
CID 89442401
CID 89442401
2-[[2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-methylamino]-2-oxoethyl]amino]-N-methylacetamide
CID 8772528

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide?
The IUPAC name of N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide (CID 112791855) is N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide is CCc1onc(C)c1C(=O)N(C)CC(=O)Nc1c(C)cccc1C.
What is the InChIKey of N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide?
The InChIKey is UZVRSQRBZZBPSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3/c1-6-14-16(13(4)20-24-14)18(23)21(5)10-15(22)19-17-11(2)8-7-9-12(17)3/h7-9H,6,10H2,1-5H3,(H,19,22).
What are the key properties of N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide?
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide has a molecular weight of 329.40 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 112791855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).