N-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide

C16H22N4O2 — CID 133334438

IUPACN-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide
SMILESCc1cccc(C)c1NC(=O)CN(C)c1nc(C(C)C)no1
InChIInChI=1S/C16H22N4O2/c1-10(2)15-18-16(22-19-15)20(5)9-13(21)17-14-11(3)7-6-8-12(14)4/h6-8,10H,9H2,1-5H3,(H,17,21)
InChIKeyVQQUOWJQBZRBMD-UHFFFAOYSA-N
MW302.38 g/mol
LogP2.88
Rot. Bonds5

About N-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide

N-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide (PubChem CID 133334438) has the molecular formula C16H22N4O2 and a molecular weight of 302.38 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide
PubChem CID133334438
Molecular FormulaC16H22N4O2
Molecular Weight302.38 g/mol
Exact Mass302.17
IUPAC NameN-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide
SMILESCc1cccc(C)c1NC(=O)CN(C)c1nc(C(C)C)no1
InChIInChI=1S/C16H22N4O2/c1-10(2)15-18-16(22-19-15)20(5)9-13(21)17-14-11(3)7-6-8-12(14)4/h6-8,10H,9H2,1-5H3,(H,17,21)
InChIKeyVQQUOWJQBZRBMD-UHFFFAOYSA-N
XLogP2.88
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(4-fluorophenyl)sulfonyl-methylamino]-N-[2-methyl-6-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenyl]acetamide
CID 56568562
2-(2-methyl-N-methylsulfonylanilino)-N-[2-methyl-6-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)phenyl]acetamide
CID 56568526
N-(2,6-dichlorophenyl)-2-[methyl-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]amino]acetamide
CID 55525642
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylamino]-N-(2,6-dimethylphenyl)acetamide
CID 38302891
2-[(6-cyano-2-pyridinyl)-methylamino]-N-(2,6-dimethylphenyl)acetamide
CID 133334372
2-[acetyl-(5-methyl-1,2-oxazol-3-yl)amino]-N-(2,6-dimethylphenyl)acetamide
CID 113181841
2-[ethyl(methyl)amino]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 60516691
2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide
CID 40760037
2-[(6-chloro-2-ethyl-5-methylpyrimidin-4-yl)-methylamino]-N-(2,6-dimethylphenyl)acetamide
CID 133334392
N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide
CID 133359021
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-ethyl-N,3-dimethyl-1,2-oxazole-4-carboxamide
CID 112791855
2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-methylamino]-N-(3-methylbutyl)acetamide
CID 9222192

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide?
The IUPAC name of N-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide (CID 133334438) is N-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide is Cc1cccc(C)c1NC(=O)CN(C)c1nc(C(C)C)no1.
What is the InChIKey of N-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide?
The InChIKey is VQQUOWJQBZRBMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O2/c1-10(2)15-18-16(22-19-15)20(5)9-13(21)17-14-11(3)7-6-8-12(14)4/h6-8,10H,9H2,1-5H3,(H,17,21).
What are the key properties of N-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide?
N-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide has a molecular weight of 302.38 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-2-[methyl-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)amino]acetamide is sourced from PubChem (CID 133334438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).