N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide

C23H23N3O3 — CID 110426122

IUPACN-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide
SMILESCc1ccc(-c2nc(CC(=O)Nc3ccc4c(c3)C(C)(C)C(=O)N4)c(C)o2)cc1
InChIInChI=1S/C23H23N3O3/c1-13-5-7-15(8-6-13)21-25-19(14(2)29-21)12-20(27)24-16-9-10-18-17(11-16)23(3,4)22(28)26-18/h5-11H,12H2,1-4H3,(H,24,27)(H,26,28)
InChIKeySZYRMNHYNMPURS-UHFFFAOYSA-N
MW389.46 g/mol
LogP4.37
Rot. Bonds4

About N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide

N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide (PubChem CID 110426122) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide.

Molecular Properties

Compound NameN-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide
PubChem CID110426122
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC NameN-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide
SMILESCc1ccc(-c2nc(CC(=O)Nc3ccc4c(c3)C(C)(C)C(=O)N4)c(C)o2)cc1
InChIInChI=1S/C23H23N3O3/c1-13-5-7-15(8-6-13)21-25-19(14(2)29-21)12-20(27)24-16-9-10-18-17(11-16)23(3,4)22(28)26-18/h5-11H,12H2,1-4H3,(H,24,27)(H,26,28)
InChIKeySZYRMNHYNMPURS-UHFFFAOYSA-N
XLogP4.37
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,3-benzodioxol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide
CID 110371664
N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110612894
N-(3,4-dimethoxyphenyl)-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110371709
2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)acetamide
CID 110619938
4-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-methylphenyl)-3-oxobutanamide
CID 126614847
N-(3-acetylphenyl)-2-[2-(4-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110371758
2-hydroxy-4-[[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetyl]amino]benzoic acid
CID 22087427
N-(6-bromo-3-pyridinyl)-2-[2-(4-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110614696
2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1H-indazol-6-yl)acetamide
CID 110770980
2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide
CID 110426261
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
CID 16620648
2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)acetamide
CID 110618656

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide?
The IUPAC name of N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide (CID 110426122) is N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide.
What is the SMILES notation for N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide?
The canonical SMILES for N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide is Cc1ccc(-c2nc(CC(=O)Nc3ccc4c(c3)C(C)(C)C(=O)N4)c(C)o2)cc1.
What is the InChIKey of N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide?
The InChIKey is SZYRMNHYNMPURS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c1-13-5-7-15(8-6-13)21-25-19(14(2)29-21)12-20(27)24-16-9-10-18-17(11-16)23(3,4)22(28)26-18/h5-11H,12H2,1-4H3,(H,24,27)(H,26,28).
What are the key properties of N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide?
N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide has a molecular weight of 389.46 g/mol, XLogP of 4.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide is sourced from PubChem (CID 110426122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).