N-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide

C12H11Cl2N3O2 — CID 110333728

IUPACN-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide
SMILESCc1nnc(CCC(=O)Nc2c(Cl)cccc2Cl)o1
InChIInChI=1S/C12H11Cl2N3O2/c1-7-16-17-11(19-7)6-5-10(18)15-12-8(13)3-2-4-9(12)14/h2-4H,5-6H2,1H3,(H,15,18)
InChIKeyJUASEWIJXSPIKT-UHFFFAOYSA-N
MW300.14 g/mol
LogP3.26
Rot. Bonds4

About N-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide

N-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide (PubChem CID 110333728) has the molecular formula C12H11Cl2N3O2 and a molecular weight of 300.14 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide
PubChem CID110333728
Molecular FormulaC12H11Cl2N3O2
Molecular Weight300.14 g/mol
Exact Mass299.02
IUPAC NameN-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide
SMILESCc1nnc(CCC(=O)Nc2c(Cl)cccc2Cl)o1
InChIInChI=1S/C12H11Cl2N3O2/c1-7-16-17-11(19-7)6-5-10(18)15-12-8(13)3-2-4-9(12)14/h2-4H,5-6H2,1H3,(H,15,18)
InChIKeyJUASEWIJXSPIKT-UHFFFAOYSA-N
XLogP3.26
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.14
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N'-bis(2,6-dichlorophenyl)butanediamide
CID 1010966
N-(2,6-dichlorophenyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide
CID 110651196
3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide
CID 110333704
N-(4-chloro-2-methoxy-5-methylphenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide
CID 110333731
N-(4-cyanophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide
CID 110333736
N,N'-bis(2,6-dichlorophenyl)pentanediamide
CID 1291740
3-(2-chlorophenyl)-N-(2,6-dichlorophenyl)propanamide
CID 51058277
N-(3-bromo-4-methylphenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide
CID 110333672
N-(2,6-dichlorophenyl)-3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide
CID 100761019
3-(4-aminophenyl)-N-(2,6-dichlorophenyl)propanamide
CID 28713241
N-(2,6-dichlorophenyl)decanamide
CID 3269237
N-(3-chlorophenyl)-3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]propanamide
CID 110334527

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide?
The IUPAC name of N-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide (CID 110333728) is N-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide is Cc1nnc(CCC(=O)Nc2c(Cl)cccc2Cl)o1.
What is the InChIKey of N-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide?
The InChIKey is JUASEWIJXSPIKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Cl2N3O2/c1-7-16-17-11(19-7)6-5-10(18)15-12-8(13)3-2-4-9(12)14/h2-4H,5-6H2,1H3,(H,15,18).
What are the key properties of N-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide?
N-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide has a molecular weight of 300.14 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide is sourced from PubChem (CID 110333728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).