2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide

C22H21N3O3 — CID 156586625

IUPAC2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(NC(=O)CC2(Cc3ccccc3)C(=O)N(C)c3ccccc32)no1
InChIInChI=1S/C22H21N3O3/c1-15-12-19(24-28-15)23-20(26)14-22(13-16-8-4-3-5-9-16)17-10-6-7-11-18(17)25(2)21(22)27/h3-12H,13-14H2,1-2H3,(H,23,24,26)
InChIKeyOARNFENXWGXIDV-UHFFFAOYSA-N
MW375.43 g/mol
LogP3.47
Rot. Bonds5

About 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide

2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide (PubChem CID 156586625) has the molecular formula C22H21N3O3 and a molecular weight of 375.43 g/mol. Its IUPAC name is 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
PubChem CID156586625
Molecular FormulaC22H21N3O3
Molecular Weight375.43 g/mol
Exact Mass375.16
IUPAC Name2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(NC(=O)CC2(Cc3ccccc3)C(=O)N(C)c3ccccc32)no1
InChIInChI=1S/C22H21N3O3/c1-15-12-19(24-28-15)23-20(26)14-22(13-16-8-4-3-5-9-16)17-10-6-7-11-18(17)25(2)21(22)27/h3-12H,13-14H2,1-2H3,(H,23,24,26)
InChIKeyOARNFENXWGXIDV-UHFFFAOYSA-N
XLogP3.47
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-phenylacetamide
CID 56873238
2-[(3S)-3-benzyl-1-methyl-2-oxoindol-3-yl]-N-[2-(1,2,4-triazol-4-yl)ethyl]acetamide
CID 95555980
2-[(3R)-3-benzyl-1-methyl-2-oxoindol-3-yl]-N-[(1-methylpyrazol-4-yl)methyl]acetamide
CID 95562977
2-[(3S)-3-benzyl-1-methyl-2-oxoindol-3-yl]-N-(2H-tetrazol-5-ylmethyl)acetamide
CID 95553473
2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-[(3-methyl-4-pyridinyl)methyl]acetamide
CID 56864431
2-[(3R)-3-benzyl-1-methyl-2-oxoindol-3-yl]-N-(3-hydroxy-2,2-dimethylpropyl)acetamide
CID 95532207
2-[[2-[(3S)-3-benzyl-1-methyl-2-oxoindol-3-yl]acetyl]amino]-2-methylpropanamide
CID 95543110
2-[(3S)-3-benzyl-1-methyl-2-oxoindol-3-yl]-N-(2-pyridin-3-ylethyl)acetamide
CID 95563231
2-[(3S)-3-benzyl-1-methyl-2-oxoindol-3-yl]-N-(oxan-4-ylmethyl)acetamide
CID 95555829
2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-[[1-(hydroxymethyl)cyclobutyl]methyl]acetamide
CID 56873886
2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N,N-bis(2-hydroxyethyl)acetamide
CID 56877849
2-[(3R)-3-benzyl-1-methyl-2-oxoindol-3-yl]-N-methyl-N-[2-(methylamino)ethyl]acetamide
CID 95563639

Frequently Asked Questions

What is the IUPAC name of 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The IUPAC name of 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide (CID 156586625) is 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The canonical SMILES for 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide is Cc1cc(NC(=O)CC2(Cc3ccccc3)C(=O)N(C)c3ccccc32)no1.
What is the InChIKey of 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The InChIKey is OARNFENXWGXIDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3/c1-15-12-19(24-28-15)23-20(26)14-22(13-16-8-4-3-5-9-16)17-10-6-7-11-18(17)25(2)21(22)27/h3-12H,13-14H2,1-2H3,(H,23,24,26).
What are the key properties of 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide has a molecular weight of 375.43 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 156586625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).