3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide

C25H23N3O5 — CID 55700663

IUPAC3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide
SMILESCOc1cc(C(=O)Nc2ccccc2-c2noc(C)n2)cc(OC)c1OCc1ccccc1
InChIInChI=1S/C25H23N3O5/c1-16-26-24(28-33-16)19-11-7-8-12-20(19)27-25(29)18-13-21(30-2)23(22(14-18)31-3)32-15-17-9-5-4-6-10-17/h4-14H,15H2,1-3H3,(H,27,29)
InChIKeyGQMRCSHCPMXPJJ-UHFFFAOYSA-N
MW445.48 g/mol
LogP4.89
Rot. Bonds8

About 3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide

3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide (PubChem CID 55700663) has the molecular formula C25H23N3O5 and a molecular weight of 445.48 g/mol. Its IUPAC name is 3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide
PubChem CID55700663
Molecular FormulaC25H23N3O5
Molecular Weight445.48 g/mol
Exact Mass445.16
IUPAC Name3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide
SMILESCOc1cc(C(=O)Nc2ccccc2-c2noc(C)n2)cc(OC)c1OCc1ccccc1
InChIInChI=1S/C25H23N3O5/c1-16-26-24(28-33-16)19-11-7-8-12-20(19)27-25(29)18-13-21(30-2)23(22(14-18)31-3)32-15-17-9-5-4-6-10-17/h4-14H,15H2,1-3H3,(H,27,29)
InChIKeyGQMRCSHCPMXPJJ-UHFFFAOYSA-N
XLogP4.89
TPSA95.71 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500445.48
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

methyl 3-[(3,5-dimethoxy-4-phenylmethoxybenzoyl)amino]-4-methylbenzoate
CID 16567479
N-(2-fluoro-5-methylphenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 9455251
4-iodo-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide
CID 55700547
3,5-dimethoxy-4-phenylmethoxy-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 46526102
3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide
CID 55700493
3,5-dimethoxy-4-phenylmethoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 139779676
N-(4-bromophenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 16567430
N-(4-chlorophenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 9243640
3-[4-methoxy-2-(methoxymethyl)-5-phenylmethoxyphenyl]-5-methyl-1,2,4-oxadiazole
CID 154225035
N-[2-(2-bromoanilino)-2-oxoethyl]-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 24681669
N-(5-carbamoyl-2,4-difluorophenyl)-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 56570661
N-(2-cyclopentylpyrazol-3-yl)-3,5-dimethoxy-4-phenylmethoxybenzamide
CID 55429489

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide?
The IUPAC name of 3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide (CID 55700663) is 3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide.
What is the SMILES notation for 3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide?
The canonical SMILES for 3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide is COc1cc(C(=O)Nc2ccccc2-c2noc(C)n2)cc(OC)c1OCc1ccccc1.
What is the InChIKey of 3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide?
The InChIKey is GQMRCSHCPMXPJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3O5/c1-16-26-24(28-33-16)19-11-7-8-12-20(19)27-25(29)18-13-21(30-2)23(22(14-18)31-3)32-15-17-9-5-4-6-10-17/h4-14H,15H2,1-3H3,(H,27,29).
What are the key properties of 3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide?
3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide has a molecular weight of 445.48 g/mol, XLogP of 4.89, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-phenylmethoxybenzamide is sourced from PubChem (CID 55700663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).