4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide

C20H16N4O2 — CID 71863321

IUPAC4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide
SMILESCc1nnc(-c2ccc(C(=O)NCc3ccnc4ccccc34)cc2)o1
InChIInChI=1S/C20H16N4O2/c1-13-23-24-20(26-13)15-8-6-14(7-9-15)19(25)22-12-16-10-11-21-18-5-3-2-4-17(16)18/h2-11H,12H2,1H3,(H,22,25)
InChIKeyYLKKPGXIMNBCMT-UHFFFAOYSA-N
MW344.37 g/mol
LogP3.52
Rot. Bonds4

About 4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide

4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide (PubChem CID 71863321) has the molecular formula C20H16N4O2 and a molecular weight of 344.37 g/mol. Its IUPAC name is 4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide.

Molecular Properties

Compound Name4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide
PubChem CID71863321
Molecular FormulaC20H16N4O2
Molecular Weight344.37 g/mol
Exact Mass344.13
IUPAC Name4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide
SMILESCc1nnc(-c2ccc(C(=O)NCc3ccnc4ccccc34)cc2)o1
InChIInChI=1S/C20H16N4O2/c1-13-23-24-20(26-13)15-8-6-14(7-9-15)19(25)22-12-16-10-11-21-18-5-3-2-4-17(16)18/h2-11H,12H2,1H3,(H,22,25)
InChIKeyYLKKPGXIMNBCMT-UHFFFAOYSA-N
XLogP3.52
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-N-(quinolin-4-ylmethyl)benzamide
CID 110734220
N-(4-hydroxy-2-methylpentyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide
CID 111540039
2-(2-methoxyphenoxy)-N-(quinolin-4-ylmethyl)acetamide
CID 71979334
2-(3-methylphenyl)-N-(quinolin-4-ylmethyl)acetamide
CID 110734253
N-[(2-hydroxycyclopentyl)methyl]-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide
CID 111540657
4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-(3-phenyl-1,2,4-oxadiazol-5-yl)propyl]benzamide
CID 97074910
4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-N-(1,3-thiazol-2-ylmethyl)benzamide
CID 91150773
N-methyl-4-[[[4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]benzoyl]amino]methyl]benzamide
CID 10225261
1-[(2-ethylphenyl)methyl]-3-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]urea
CID 71864877
2-(2-cyanophenoxy)-N-(quinolin-4-ylmethyl)acetamide
CID 71979331
N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-2-phenylacetamide
CID 110725539
4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]-N-(thiophen-2-ylmethyl)benzamide
CID 134030447

Frequently Asked Questions

What is the IUPAC name of 4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide?
The IUPAC name of 4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide (CID 71863321) is 4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide.
What is the SMILES notation for 4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide?
The canonical SMILES for 4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide is Cc1nnc(-c2ccc(C(=O)NCc3ccnc4ccccc34)cc2)o1.
What is the InChIKey of 4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide?
The InChIKey is YLKKPGXIMNBCMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O2/c1-13-23-24-20(26-13)15-8-6-14(7-9-15)19(25)22-12-16-10-11-21-18-5-3-2-4-17(16)18/h2-11H,12H2,1H3,(H,22,25).
What are the key properties of 4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide?
4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide has a molecular weight of 344.37 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(quinolin-4-ylmethyl)benzamide is sourced from PubChem (CID 71863321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).