N-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide

C19H17N5O3 — CID 17496655

IUPACN-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide
SMILESCCn1c(NC(=O)Cn2nc(-c3ccccc3)oc2=O)nc2ccccc21
InChIInChI=1S/C19H17N5O3/c1-2-23-15-11-7-6-10-14(15)20-18(23)21-16(25)12-24-19(26)27-17(22-24)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3,(H,20,21,25)
InChIKeyYAORKMRJIPGWPL-UHFFFAOYSA-N
MW363.38 g/mol
LogP2.51
Rot. Bonds5

About N-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide

N-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide (PubChem CID 17496655) has the molecular formula C19H17N5O3 and a molecular weight of 363.38 g/mol. Its IUPAC name is N-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide
PubChem CID17496655
Molecular FormulaC19H17N5O3
Molecular Weight363.38 g/mol
Exact Mass363.13
IUPAC NameN-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide
SMILESCCn1c(NC(=O)Cn2nc(-c3ccccc3)oc2=O)nc2ccccc21
InChIInChI=1S/C19H17N5O3/c1-2-23-15-11-7-6-10-14(15)20-18(23)21-16(25)12-24-19(26)27-17(22-24)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3,(H,20,21,25)
InChIKeyYAORKMRJIPGWPL-UHFFFAOYSA-N
XLogP2.51
TPSA94.95 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.38
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide?
The IUPAC name of N-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide (CID 17496655) is N-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide.
What is the SMILES notation for N-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide?
The canonical SMILES for N-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide is CCn1c(NC(=O)Cn2nc(-c3ccccc3)oc2=O)nc2ccccc21.
What is the InChIKey of N-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide?
The InChIKey is YAORKMRJIPGWPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O3/c1-2-23-15-11-7-6-10-14(15)20-18(23)21-16(25)12-24-19(26)27-17(22-24)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3,(H,20,21,25).
What are the key properties of N-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide?
N-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide has a molecular weight of 363.38 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylbenzimidazol-2-yl)-2-(2-oxo-5-phenyl-1,3,4-oxadiazol-3-yl)acetamide is sourced from PubChem (CID 17496655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).