N-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide

C21H16N4O2 — CID 67153788

IUPACN-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide
SMILESO=C(Nc1cc(-c2nnc(Cc3ccccc3)o2)ccn1)c1ccccc1
InChIInChI=1S/C21H16N4O2/c26-20(16-9-5-2-6-10-16)23-18-14-17(11-12-22-18)21-25-24-19(27-21)13-15-7-3-1-4-8-15/h1-12,14H,13H2,(H,22,23,26)
InChIKeyYMRRILVYMSLBRG-UHFFFAOYSA-N
MW356.39 g/mol
LogP3.97
Rot. Bonds5

About N-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide

N-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide (PubChem CID 67153788) has the molecular formula C21H16N4O2 and a molecular weight of 356.39 g/mol. Its IUPAC name is N-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide.

Molecular Properties

Compound NameN-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide
PubChem CID67153788
Molecular FormulaC21H16N4O2
Molecular Weight356.39 g/mol
Exact Mass356.13
IUPAC NameN-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide
SMILESO=C(Nc1cc(-c2nnc(Cc3ccccc3)o2)ccn1)c1ccccc1
InChIInChI=1S/C21H16N4O2/c26-20(16-9-5-2-6-10-16)23-18-14-17(11-12-22-18)21-25-24-19(27-21)13-15-7-3-1-4-8-15/h1-12,14H,13H2,(H,22,23,26)
InChIKeyYMRRILVYMSLBRG-UHFFFAOYSA-N
XLogP3.97
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.39
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide
CID 67153787
N-[4-(4-cyanophenyl)-2-pyridinyl]benzamide
CID 155673932
2-benzyl-5-thiophen-3-yl-1,3,4-oxadiazole
CID 29132376
2-benzyl-5-pyridin-2-yl-1,3,4-oxadiazole
CID 156786960
4-(5-benzyl-1,3,4-oxadiazol-2-yl)-N-[3-(dimethylamino)propyl]benzamide
CID 21108809
1-benzyl-3-[4-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]-2-pyridinyl]urea
CID 68663676
4-[[5-[3-(5-benzyl-1,3,4-oxadiazol-2-yl)phenyl]tetrazol-2-yl]methyl]benzoic acid
CID 68976947
N-(5-benzyl-1,3,4-oxadiazol-2-yl)-1,3-benzothiazole-6-carboxamide
CID 16917410
2-benzamido-N-(3-phenylpropyl)pyridine-4-carboxamide
CID 67153857
[4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]carbamic acid
CID 166061915
N-[5-[3-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]benzamide
CID 170341324
N-[4-(difluoromethyl)-2-pyridinyl]benzamide
CID 118627561

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide?
The IUPAC name of N-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide (CID 67153788) is N-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide.
What is the SMILES notation for N-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide?
The canonical SMILES for N-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide is O=C(Nc1cc(-c2nnc(Cc3ccccc3)o2)ccn1)c1ccccc1.
What is the InChIKey of N-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide?
The InChIKey is YMRRILVYMSLBRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N4O2/c26-20(16-9-5-2-6-10-16)23-18-14-17(11-12-22-18)21-25-24-19(27-21)13-15-7-3-1-4-8-15/h1-12,14H,13H2,(H,22,23,26).
What are the key properties of N-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide?
N-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide has a molecular weight of 356.39 g/mol, XLogP of 3.97, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-benzyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide is sourced from PubChem (CID 67153788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).