N-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide

C17H17N5O3 — CID 52906391

IUPACN-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide
SMILESCCOc1cccc(CNC(=O)Cc2nnc(-c3cnccn3)o2)c1
InChIInChI=1S/C17H17N5O3/c1-2-24-13-5-3-4-12(8-13)10-20-15(23)9-16-21-22-17(25-16)14-11-18-6-7-19-14/h3-8,11H,2,9-10H2,1H3,(H,20,23)
InChIKeyGAZCHRAUSKIYEG-UHFFFAOYSA-N
MW339.36 g/mol
LogP1.78
Rot. Bonds7

About N-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide

N-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide (PubChem CID 52906391) has the molecular formula C17H17N5O3 and a molecular weight of 339.36 g/mol. Its IUPAC name is N-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide.

Molecular Properties

Compound NameN-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide
PubChem CID52906391
Molecular FormulaC17H17N5O3
Molecular Weight339.36 g/mol
Exact Mass339.13
IUPAC NameN-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide
SMILESCCOc1cccc(CNC(=O)Cc2nnc(-c3cnccn3)o2)c1
InChIInChI=1S/C17H17N5O3/c1-2-24-13-5-3-4-12(8-13)10-20-15(23)9-16-21-22-17(25-16)14-11-18-6-7-19-14/h3-8,11H,2,9-10H2,1H3,(H,20,23)
InChIKeyGAZCHRAUSKIYEG-UHFFFAOYSA-N
XLogP1.78
TPSA103.03 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.36
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[(3-ethoxyphenyl)methyl]-2-[5-(3-methylthiophen-2-yl)-1,3,4-oxadiazol-2-yl]acetamide
CID 53162130
N-[(4-chlorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide
CID 53162270
N-[(3-chloro-4-fluorophenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide
CID 52906389
2-(3-ethoxyphenoxy)-N-(pyridin-4-ylmethyl)acetamide
CID 112977719
2-(3-methoxyphenyl)-N-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide
CID 92599497
2-(5-phenyl-1,3,4-oxadiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide
CID 50848268
N-benzyl-2-(3-ethoxyphenoxy)acetamide
CID 112977703
N-[(3-ethoxyphenyl)methyl]-2-(4-fluorophenoxy)acetamide
CID 53288657
N-[(3-ethoxyphenyl)methyl]-2-(1,2,4-triazol-4-yl)acetamide
CID 166187909
N-(4-chloro-2-methylphenyl)-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide
CID 53162255
N-[(3-ethoxyphenyl)methyl]-2-(4-propan-2-ylphenoxy)acetamide
CID 30384331
N-[(3-ethoxyphenyl)methyl]-4-hydroxybutanamide
CID 79191557

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
The IUPAC name of N-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide (CID 52906391) is N-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide.
What is the SMILES notation for N-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
The canonical SMILES for N-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide is CCOc1cccc(CNC(=O)Cc2nnc(-c3cnccn3)o2)c1.
What is the InChIKey of N-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
The InChIKey is GAZCHRAUSKIYEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O3/c1-2-24-13-5-3-4-12(8-13)10-20-15(23)9-16-21-22-17(25-16)14-11-18-6-7-19-14/h3-8,11H,2,9-10H2,1H3,(H,20,23).
What are the key properties of N-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide?
N-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide has a molecular weight of 339.36 g/mol, XLogP of 1.78, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethoxyphenyl)methyl]-2-(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)acetamide is sourced from PubChem (CID 52906391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).