4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide

C24H21N3O3 — CID 14100144

IUPAC4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide
SMILESCOc1ccc(-c2nc(C(=O)Nc3ccccc3)[nH]c2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H21N3O3/c1-29-19-12-8-16(9-13-19)21-22(17-10-14-20(30-2)15-11-17)27-23(26-21)24(28)25-18-6-4-3-5-7-18/h3-15H,1-2H3,(H,25,28)(H,26,27)
InChIKeySPCXRWJVRXXXHS-UHFFFAOYSA-N
MW399.45 g/mol
LogP5.01
Rot. Bonds6

About 4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide

4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide (PubChem CID 14100144) has the molecular formula C24H21N3O3 and a molecular weight of 399.45 g/mol. Its IUPAC name is 4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide.

Molecular Properties

Compound Name4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide
PubChem CID14100144
Molecular FormulaC24H21N3O3
Molecular Weight399.45 g/mol
Exact Mass399.16
IUPAC Name4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide
SMILESCOc1ccc(-c2nc(C(=O)Nc3ccccc3)[nH]c2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H21N3O3/c1-29-19-12-8-16(9-13-19)21-22(17-10-14-20(30-2)15-11-17)27-23(26-21)24(28)25-18-6-4-3-5-7-18/h3-15H,1-2H3,(H,25,28)(H,26,27)
InChIKeySPCXRWJVRXXXHS-UHFFFAOYSA-N
XLogP5.01
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500399.45
LogP ≤ 55.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4,5-bis(4-chlorophenyl)-N-(4-fluorophenyl)-1H-imidazole-2-carboxamide
CID 14100150
2-[4-(4,5-diphenyl-1H-imidazol-2-yl)phenoxy]-N-(4-methoxyphenyl)acetamide
CID 155908619
4-(4-methoxyphenyl)-2-[4-[4-(4-methoxyphenyl)-5-phenyl-1H-imidazol-2-yl]phenyl]-5-phenyl-1H-imidazole
CID 136591177
[4-[2-(4-methoxyphenyl)-4-phenyl-1H-imidazol-5-yl]phenyl]-[4-[2-(4-methoxyphenyl)-5-phenyl-1H-imidazol-4-yl]phenyl]methanone
CID 135495721
N-[2-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]sulfanyl]ethyl]-2-phenylacetamide
CID 21104898
N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 821516
4,5-bis[4-(4-methoxyphenyl)phenyl]-2-phenyl-1H-imidazole
CID 86068927
N-[4-(4-methoxyphenyl)-6-oxo-2-phenyl-1H-pyrimidin-5-yl]acetamide
CID 136815025
4-[3-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]sulfanyl]propanoylamino]benzoic acid
CID 23804200
4-(4-methoxyphenyl)-2-methyl-5-nitro-N,6-diphenylpyridine-3-carboxamide
CID 171904998
3-[3-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]sulfanyl]propanoylamino]benzoic acid
CID 23804202
3-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]sulfanyl]-N-(4-iodophenyl)propanamide
CID 23889215

Frequently Asked Questions

What is the IUPAC name of 4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide?
The IUPAC name of 4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide (CID 14100144) is 4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide.
What is the SMILES notation for 4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide?
The canonical SMILES for 4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide is COc1ccc(-c2nc(C(=O)Nc3ccccc3)[nH]c2-c2ccc(OC)cc2)cc1.
What is the InChIKey of 4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide?
The InChIKey is SPCXRWJVRXXXHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O3/c1-29-19-12-8-16(9-13-19)21-22(17-10-14-20(30-2)15-11-17)27-23(26-21)24(28)25-18-6-4-3-5-7-18/h3-15H,1-2H3,(H,25,28)(H,26,27).
What are the key properties of 4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide?
4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide has a molecular weight of 399.45 g/mol, XLogP of 5.01, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis(4-methoxyphenyl)-N-phenyl-1H-imidazole-2-carboxamide is sourced from PubChem (CID 14100144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).