N-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide

C23H19ClN4O3 — CID 51366753

IUPACN-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide
SMILESCc1cccc(-c2noc(-c3ccc(=O)n(CC(=O)NCc4ccccc4Cl)c3)n2)c1
InChIInChI=1S/C23H19ClN4O3/c1-15-5-4-7-16(11-15)22-26-23(31-27-22)18-9-10-21(30)28(13-18)14-20(29)25-12-17-6-2-3-8-19(17)24/h2-11,13H,12,14H2,1H3,(H,25,29)
InChIKeyARSFMDJQFGITEK-UHFFFAOYSA-N
MW434.88 g/mol
LogP3.84
Rot. Bonds6

About N-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide

N-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide (PubChem CID 51366753) has the molecular formula C23H19ClN4O3 and a molecular weight of 434.88 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide
PubChem CID51366753
Molecular FormulaC23H19ClN4O3
Molecular Weight434.88 g/mol
Exact Mass434.11
IUPAC NameN-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide
SMILESCc1cccc(-c2noc(-c3ccc(=O)n(CC(=O)NCc4ccccc4Cl)c3)n2)c1
InChIInChI=1S/C23H19ClN4O3/c1-15-5-4-7-16(11-15)22-26-23(31-27-22)18-9-10-21(30)28(13-18)14-20(29)25-12-17-6-2-3-8-19(17)24/h2-11,13H,12,14H2,1H3,(H,25,29)
InChIKeyARSFMDJQFGITEK-UHFFFAOYSA-N
XLogP3.84
TPSA90.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.88
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide?
The IUPAC name of N-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide (CID 51366753) is N-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide is Cc1cccc(-c2noc(-c3ccc(=O)n(CC(=O)NCc4ccccc4Cl)c3)n2)c1.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide?
The InChIKey is ARSFMDJQFGITEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19ClN4O3/c1-15-5-4-7-16(11-15)22-26-23(31-27-22)18-9-10-21(30)28(13-18)14-20(29)25-12-17-6-2-3-8-19(17)24/h2-11,13H,12,14H2,1H3,(H,25,29).
What are the key properties of N-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide?
N-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide has a molecular weight of 434.88 g/mol, XLogP of 3.84, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-2-[5-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]acetamide is sourced from PubChem (CID 51366753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).