N-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide

C26H25N3O3 — CID 126744189

IUPACN-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2nc(Cc3ccccc3)c(-c3ccc(OC)cc3)n2C)cc1
InChIInChI=1S/C26H25N3O3/c1-29-24(19-9-13-21(31-2)14-10-19)23(17-18-7-5-4-6-8-18)27-26(29)28-25(30)20-11-15-22(32-3)16-12-20/h4-16H,17H2,1-3H3,(H,27,28,30)
InChIKeyOFIYFGTVPSIRKC-UHFFFAOYSA-N
MW427.50 g/mol
LogP4.95
Rot. Bonds7

About N-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide

N-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide (PubChem CID 126744189) has the molecular formula C26H25N3O3 and a molecular weight of 427.50 g/mol. Its IUPAC name is N-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide
PubChem CID126744189
Molecular FormulaC26H25N3O3
Molecular Weight427.50 g/mol
Exact Mass427.19
IUPAC NameN-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2nc(Cc3ccccc3)c(-c3ccc(OC)cc3)n2C)cc1
InChIInChI=1S/C26H25N3O3/c1-29-24(19-9-13-21(31-2)14-10-19)23(17-18-7-5-4-6-8-18)27-26(29)28-25(30)20-11-15-22(32-3)16-12-20/h4-16H,17H2,1-3H3,(H,27,28,30)
InChIKeyOFIYFGTVPSIRKC-UHFFFAOYSA-N
XLogP4.95
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.50
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-benzyl-5-(4-chlorophenyl)-1-methylimidazol-2-yl]-4-chlorobenzamide
CID 126744129
N-[4-(cyclopropylmethyl)-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide
CID 126744125
N-[5-benzyl-4-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-chlorobenzamide
CID 135349193
N-(4-benzyl-1-methyl-5-phenylimidazol-2-yl)-2-methylpropanamide
CID 118384333
N-[5-(4-methoxyphenyl)-1-methylimidazol-2-yl]benzamide
CID 1096852
N'-(3-benzylquinoxalin-2-yl)-4-methoxybenzohydrazide
CID 118731256
N-(1-methylbenzimidazol-2-yl)-4-phenoxybenzamide
CID 72725713
N-(5-benzyl-4-phenyl-3H-pyrrol-2-yl)-4-methoxybenzamide
CID 161413268
4-[benzyl(methylsulfonyl)amino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]benzamide
CID 100729465
4-methoxy-N-[1-methyl-2-(2-phenylethyl)benzimidazol-5-yl]benzamide
CID 46328919
4-[4-(benzylsulfamoyl)phenyl]-N-(4-methoxyphenyl)benzamide
CID 46385858
N-(2-amino-5-phenylphenyl)-4-methoxybenzamide;N-methylmethanamine
CID 66894745

Frequently Asked Questions

What is the IUPAC name of N-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide?
The IUPAC name of N-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide (CID 126744189) is N-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide.
What is the SMILES notation for N-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide?
The canonical SMILES for N-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide is COc1ccc(C(=O)Nc2nc(Cc3ccccc3)c(-c3ccc(OC)cc3)n2C)cc1.
What is the InChIKey of N-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide?
The InChIKey is OFIYFGTVPSIRKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N3O3/c1-29-24(19-9-13-21(31-2)14-10-19)23(17-18-7-5-4-6-8-18)27-26(29)28-25(30)20-11-15-22(32-3)16-12-20/h4-16H,17H2,1-3H3,(H,27,28,30).
What are the key properties of N-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide?
N-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide has a molecular weight of 427.50 g/mol, XLogP of 4.95, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-benzyl-5-(4-methoxyphenyl)-1-methylimidazol-2-yl]-4-methoxybenzamide is sourced from PubChem (CID 126744189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).