N-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide

C21H20N4O2 — CID 53032204

IUPACN-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
SMILESCCc1cccc(NC(=O)Cn2ccc3ccc(-c4nnc(C)o4)cc32)c1
InChIInChI=1S/C21H20N4O2/c1-3-15-5-4-6-18(11-15)22-20(26)13-25-10-9-16-7-8-17(12-19(16)25)21-24-23-14(2)27-21/h4-12H,3,13H2,1-2H3,(H,22,26)
InChIKeyRJVATOQFXPUJCH-UHFFFAOYSA-N
MW360.42 g/mol
LogP4.20
Rot. Bonds5

About N-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide

N-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide (PubChem CID 53032204) has the molecular formula C21H20N4O2 and a molecular weight of 360.42 g/mol. Its IUPAC name is N-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
PubChem CID53032204
Molecular FormulaC21H20N4O2
Molecular Weight360.42 g/mol
Exact Mass360.16
IUPAC NameN-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
SMILESCCc1cccc(NC(=O)Cn2ccc3ccc(-c4nnc(C)o4)cc32)c1
InChIInChI=1S/C21H20N4O2/c1-3-15-5-4-6-18(11-15)22-20(26)13-25-10-9-16-7-8-17(12-19(16)25)21-24-23-14(2)27-21/h4-12H,3,13H2,1-2H3,(H,22,26)
InChIKeyRJVATOQFXPUJCH-UHFFFAOYSA-N
XLogP4.20
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.42
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
The IUPAC name of N-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide (CID 53032204) is N-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide.
What is the SMILES notation for N-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
The canonical SMILES for N-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide is CCc1cccc(NC(=O)Cn2ccc3ccc(-c4nnc(C)o4)cc32)c1.
What is the InChIKey of N-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
The InChIKey is RJVATOQFXPUJCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O2/c1-3-15-5-4-6-18(11-15)22-20(26)13-25-10-9-16-7-8-17(12-19(16)25)21-24-23-14(2)27-21/h4-12H,3,13H2,1-2H3,(H,22,26).
What are the key properties of N-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
N-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide has a molecular weight of 360.42 g/mol, XLogP of 4.20, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylphenyl)-2-[6-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide is sourced from PubChem (CID 53032204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).