2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide

C17H15N3O4 — CID 3518645

IUPAC2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide
SMILESCOc1cccc(OC)c1C(=O)Nc1nnc(-c2ccccc2)o1
InChIInChI=1S/C17H15N3O4/c1-22-12-9-6-10-13(23-2)14(12)15(21)18-17-20-19-16(24-17)11-7-4-3-5-8-11/h3-10H,1-2H3,(H,18,20,21)
InChIKeyBZUHFNDREVSBJA-UHFFFAOYSA-N
MW325.32 g/mol
LogP3.01
Rot. Bonds5

About 2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide

2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide (PubChem CID 3518645) has the molecular formula C17H15N3O4 and a molecular weight of 325.32 g/mol. Its IUPAC name is 2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide.

Molecular Properties

Compound Name2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide
PubChem CID3518645
Molecular FormulaC17H15N3O4
Molecular Weight325.32 g/mol
Exact Mass325.11
IUPAC Name2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide
SMILESCOc1cccc(OC)c1C(=O)Nc1nnc(-c2ccccc2)o1
InChIInChI=1S/C17H15N3O4/c1-22-12-9-6-10-13(23-2)14(12)15(21)18-17-20-19-16(24-17)11-7-4-3-5-8-11/h3-10H,1-2H3,(H,18,20,21)
InChIKeyBZUHFNDREVSBJA-UHFFFAOYSA-N
XLogP3.01
TPSA86.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.32
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]-2,6-dimethoxybenzamide
CID 5185834
N-[5-(2,5-dichlorophenyl)-1,3,4-oxadiazol-2-yl]-2,6-dimethoxybenzamide
CID 7533192
2-methoxy-N-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 3367763
2,5-dimethoxy-N-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 16848805
N-[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-phenoxybenzamide
CID 8698901
2,3-dimethoxy-N-[5-(4-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 7578119
2-methoxy-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]benzamide
CID 17171705
2,3-dimethoxy-N-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 7243979
N-[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-2-methylbenzamide
CID 7655700
N-[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methoxyphenoxy)acetamide
CID 43976109
3,4-dimethoxy-N-[5-(3-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 7577972
2-methylsulfanyl-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide
CID 7565083

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide?
The IUPAC name of 2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide (CID 3518645) is 2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide.
What is the SMILES notation for 2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide?
The canonical SMILES for 2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide is COc1cccc(OC)c1C(=O)Nc1nnc(-c2ccccc2)o1.
What is the InChIKey of 2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide?
The InChIKey is BZUHFNDREVSBJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O4/c1-22-12-9-6-10-13(23-2)14(12)15(21)18-17-20-19-16(24-17)11-7-4-3-5-8-11/h3-10H,1-2H3,(H,18,20,21).
What are the key properties of 2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide?
2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide has a molecular weight of 325.32 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide is sourced from PubChem (CID 3518645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).