N-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide

C20H15ClN4O2 — CID 53162174

IUPACN-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide
SMILESCc1ccc(NC(=O)Cc2nnc(-c3ccc4ncccc4c3)o2)c(Cl)c1
InChIInChI=1S/C20H15ClN4O2/c1-12-4-6-17(15(21)9-12)23-18(26)11-19-24-25-20(27-19)14-5-7-16-13(10-14)3-2-8-22-16/h2-10H,11H2,1H3,(H,23,26)
InChIKeyGYFZLWAZVOXCQM-UHFFFAOYSA-N
MW378.82 g/mol
LogP4.43
Rot. Bonds4

About N-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide

N-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide (PubChem CID 53162174) has the molecular formula C20H15ClN4O2 and a molecular weight of 378.82 g/mol. Its IUPAC name is N-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide.

Molecular Properties

Compound NameN-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide
PubChem CID53162174
Molecular FormulaC20H15ClN4O2
Molecular Weight378.82 g/mol
Exact Mass378.09
IUPAC NameN-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide
SMILESCc1ccc(NC(=O)Cc2nnc(-c3ccc4ncccc4c3)o2)c(Cl)c1
InChIInChI=1S/C20H15ClN4O2/c1-12-4-6-17(15(21)9-12)23-18(26)11-19-24-25-20(27-19)14-5-7-16-13(10-14)3-2-8-22-16/h2-10H,11H2,1H3,(H,23,26)
InChIKeyGYFZLWAZVOXCQM-UHFFFAOYSA-N
XLogP4.43
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.82
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-tert-butylphenyl)-4-[3-chloro-5-(5-methyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]-3,6-dihydro-2H-pyridine-1-carboxamide
CID 71466725
4-[3-chloro-5-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-yl]-N-[4-(trifluoromethyl)phenyl]-3,6-dihydro-2H-pyridine-1-carboxamide
CID 71042916
N-(5-Fluoro-2-methylphenyl)-2-[5-(quinolin-6-YL)-1,3,4-oxadiazol-2-YL]acetamide
CID 53162160
N-(4-Fluoro-2-methylphenyl)-2-[5-(quinolin-6-YL)-1,3,4-oxadiazol-2-YL]acetamide
CID 53162177
N-[2-(4-Chlorophenyl)ethyl]-2-[5-(quinolin-6-YL)-1,3,4-oxadiazol-2-YL]acetamide
CID 53162193
Neuraminidase-IN-17
CID 168866591
N-(4-chlorobenzyl)-2-(5-(quinolin-6-yl)-1,3,4-oxadiazol-2-yl)acetamide
CID 49666526
2-({4-[(3,4-dimethylphenyl)sulfonyl]piperazin-1-yl}methyl)-3-(4-ethylphenyl)-3H-imidazo[4,5-b]pyridine
CID 49666528
N-(3-Fluorophenyl)-2-[5-(quinolin-6-YL)-1,3,4-oxadiazol-2-YL]acetamide
CID 53162141
N-(2-Fluorophenyl)-2-[5-(quinolin-6-YL)-1,3,4-oxadiazol-2-YL]acetamide
CID 53162142
N-(4-Fluorophenyl)-2-[5-(quinolin-6-YL)-1,3,4-oxadiazol-2-YL]acetamide
CID 53162143
2-[5-(Quinolin-6-YL)-1,3,4-oxadiazol-2-YL]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 53162144

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide?
The IUPAC name of N-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide (CID 53162174) is N-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide.
What is the SMILES notation for N-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide?
The canonical SMILES for N-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide is Cc1ccc(NC(=O)Cc2nnc(-c3ccc4ncccc4c3)o2)c(Cl)c1.
What is the InChIKey of N-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide?
The InChIKey is GYFZLWAZVOXCQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClN4O2/c1-12-4-6-17(15(21)9-12)23-18(26)11-19-24-25-20(27-19)14-5-7-16-13(10-14)3-2-8-22-16/h2-10H,11H2,1H3,(H,23,26).
What are the key properties of N-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide?
N-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide has a molecular weight of 378.82 g/mol, XLogP of 4.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-methylphenyl)-2-(5-quinolin-6-yl-1,3,4-oxadiazol-2-yl)acetamide is sourced from PubChem (CID 53162174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).