2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide

C19H17N3O4 — CID 31693977

IUPAC2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide
SMILESCOc1cc2c(cc1NCC(=O)Nc1cc(C)no1)oc1ccccc12
InChIInChI=1S/C19H17N3O4/c1-11-7-19(26-22-11)21-18(23)10-20-14-9-16-13(8-17(14)24-2)12-5-3-4-6-15(12)25-16/h3-9,20H,10H2,1-2H3,(H,21,23)
InChIKeyLZRVZFYKLIIENN-UHFFFAOYSA-N
MW351.36 g/mol
LogP3.94
Rot. Bonds5

About 2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide

2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide (PubChem CID 31693977) has the molecular formula C19H17N3O4 and a molecular weight of 351.36 g/mol. Its IUPAC name is 2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide.

Molecular Properties

Compound Name2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide
PubChem CID31693977
Molecular FormulaC19H17N3O4
Molecular Weight351.36 g/mol
Exact Mass351.12
IUPAC Name2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide
SMILESCOc1cc2c(cc1NCC(=O)Nc1cc(C)no1)oc1ccccc12
InChIInChI=1S/C19H17N3O4/c1-11-7-19(26-22-11)21-18(23)10-20-14-9-16-13(8-17(14)24-2)12-5-3-4-6-15(12)25-16/h3-9,20H,10H2,1-2H3,(H,21,23)
InChIKeyLZRVZFYKLIIENN-UHFFFAOYSA-N
XLogP3.94
TPSA89.53 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.36
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_OC_alk_A(4)', 'substructure': 'N/A'}

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Related Compounds

N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-2-[(2-methoxydibenzofuran-3-yl)amino]acetamide
CID 24583231
N,N-diethyl-4-[[2-[(2-methoxydibenzofuran-3-yl)amino]acetyl]amino]benzamide
CID 42068388
N-[5-(diethylsulfamoyl)-2-methylphenyl]-2-[(2-methoxydibenzofuran-3-yl)amino]acetamide
CID 24583228
2-[(2-methoxydibenzofuran-3-yl)amino]-N-(4-piperidin-1-ylphenyl)acetamide
CID 16580953
N-(2-methoxydibenzofuran-3-yl)-2-[4-[methyl(propan-2-yl)sulfamoyl]anilino]acetamide
CID 24616682
N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide
CID 2935191
N-[3-[[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl]amino]-4-methylphenyl]cyclopropanecarboxamide
CID 55897560
2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 42068320
1-(2-hydroxy-1-phenylethyl)-3-(2-methoxydibenzofuran-3-yl)urea
CID 72686859
N-(1-acetylpiperidin-4-yl)-2-[(2-methoxydibenzofuran-3-yl)amino]acetamide
CID 86910638
2-[(2-methoxydibenzofuran-3-yl)amino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone
CID 41397481
2-(2-iodoanilino)-N-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 31691858

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide?
The IUPAC name of 2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide (CID 31693977) is 2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide.
What is the SMILES notation for 2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide?
The canonical SMILES for 2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide is COc1cc2c(cc1NCC(=O)Nc1cc(C)no1)oc1ccccc12.
What is the InChIKey of 2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide?
The InChIKey is LZRVZFYKLIIENN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O4/c1-11-7-19(26-22-11)21-18(23)10-20-14-9-16-13(8-17(14)24-2)12-5-3-4-6-15(12)25-16/h3-9,20H,10H2,1-2H3,(H,21,23).
What are the key properties of 2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide?
2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide has a molecular weight of 351.36 g/mol, XLogP of 3.94, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxydibenzofuran-3-yl)amino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide is sourced from PubChem (CID 31693977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).