2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide

C20H15N3O3 — CID 51119222

IUPAC2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide
SMILESCc1[nH]c2ccccc2c1C(=O)C(=O)Nc1cccc(-c2cnco2)c1
InChIInChI=1S/C20H15N3O3/c1-12-18(15-7-2-3-8-16(15)22-12)19(24)20(25)23-14-6-4-5-13(9-14)17-10-21-11-26-17/h2-11,22H,1H3,(H,23,25)
InChIKeyPRRWLYVKNKBAAR-UHFFFAOYSA-N
MW345.36 g/mol
LogP3.95
Rot. Bonds4

About 2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide

2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide (PubChem CID 51119222) has the molecular formula C20H15N3O3 and a molecular weight of 345.36 g/mol. Its IUPAC name is 2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide.

Molecular Properties

Compound Name2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide
PubChem CID51119222
Molecular FormulaC20H15N3O3
Molecular Weight345.36 g/mol
Exact Mass345.11
IUPAC Name2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide
SMILESCc1[nH]c2ccccc2c1C(=O)C(=O)Nc1cccc(-c2cnco2)c1
InChIInChI=1S/C20H15N3O3/c1-12-18(15-7-2-3-8-16(15)22-12)19(24)20(25)23-14-6-4-5-13(9-14)17-10-21-11-26-17/h2-11,22H,1H3,(H,23,25)
InChIKeyPRRWLYVKNKBAAR-UHFFFAOYSA-N
XLogP3.95
TPSA87.99 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.36
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

2-(2-methyl-1H-indol-3-yl)-2-oxo-N-(3-phenoxyphenyl)acetamide
CID 44596683
N-methyl-3-[[2-(2-methyl-1H-indol-3-yl)-2-oxoacetyl]amino]benzamide
CID 39058857
2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide
CID 47265687
3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide
CID 47051399
3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]but-2-enamide
CID 47353684
2-(2-methyl-1H-indol-3-yl)-2-oxo-N-[3-(piperidin-1-ylmethyl)phenyl]acetamide
CID 38840945
2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide
CID 76888066
2-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide
CID 63678754
N-(9H-fluoren-2-yl)-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide
CID 5297197
2,4-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]-6-oxopyran-3-carboxamide
CID 71865394
N-[3-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide
CID 39040258
2-(methylamino)-N-[3-(1,3-oxazol-5-yl)phenyl]-3-phenylpropanamide
CID 123157870

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide?
The IUPAC name of 2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide (CID 51119222) is 2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide.
What is the SMILES notation for 2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide?
The canonical SMILES for 2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide is Cc1[nH]c2ccccc2c1C(=O)C(=O)Nc1cccc(-c2cnco2)c1.
What is the InChIKey of 2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide?
The InChIKey is PRRWLYVKNKBAAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O3/c1-12-18(15-7-2-3-8-16(15)22-12)19(24)20(25)23-14-6-4-5-13(9-14)17-10-21-11-26-17/h2-11,22H,1H3,(H,23,25).
What are the key properties of 2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide?
2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide has a molecular weight of 345.36 g/mol, XLogP of 3.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-1H-indol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]-2-oxoacetamide is sourced from PubChem (CID 51119222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).