N-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide

C15H11ClN4O2 — CID 46321553

IUPACN-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide
SMILESCc1nc(-c2cccc(C(=O)Nc3ccc(Cl)cn3)c2)no1
InChIInChI=1S/C15H11ClN4O2/c1-9-18-14(20-22-9)10-3-2-4-11(7-10)15(21)19-13-6-5-12(16)8-17-13/h2-8H,1H3,(H,17,19,21)
InChIKeySYOKWXONDZBYOY-UHFFFAOYSA-N
MW314.73 g/mol
LogP3.35
Rot. Bonds3

About N-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide

N-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide (PubChem CID 46321553) has the molecular formula C15H11ClN4O2 and a molecular weight of 314.73 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide
PubChem CID46321553
Molecular FormulaC15H11ClN4O2
Molecular Weight314.73 g/mol
Exact Mass314.06
IUPAC NameN-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide
SMILESCc1nc(-c2cccc(C(=O)Nc3ccc(Cl)cn3)c2)no1
InChIInChI=1S/C15H11ClN4O2/c1-9-18-14(20-22-9)10-3-2-4-11(7-10)15(21)19-13-6-5-12(16)8-17-13/h2-8H,1H3,(H,17,19,21)
InChIKeySYOKWXONDZBYOY-UHFFFAOYSA-N
XLogP3.35
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.73
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide (CID 46321553) is N-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide is Cc1nc(-c2cccc(C(=O)Nc3ccc(Cl)cn3)c2)no1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide?
The InChIKey is SYOKWXONDZBYOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN4O2/c1-9-18-14(20-22-9)10-3-2-4-11(7-10)15(21)19-13-6-5-12(16)8-17-13/h2-8H,1H3,(H,17,19,21).
What are the key properties of N-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide?
N-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide has a molecular weight of 314.73 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide is sourced from PubChem (CID 46321553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).