1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide

C22H23ClN4O2 — CID 22285405

IUPAC1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide
SMILESCc1ccc(-c2nc(C(=O)NN3CCOCC3)cn2-c2ccc(Cl)cc2)c(C)c1
InChIInChI=1S/C22H23ClN4O2/c1-15-3-8-19(16(2)13-15)21-24-20(22(28)25-26-9-11-29-12-10-26)14-27(21)18-6-4-17(23)5-7-18/h3-8,13-14H,9-12H2,1-2H3,(H,25,28)
InChIKeyREMBHOUNAHEQSD-UHFFFAOYSA-N
MW410.91 g/mol
LogP3.79
Rot. Bonds4

About 1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide

1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide (PubChem CID 22285405) has the molecular formula C22H23ClN4O2 and a molecular weight of 410.91 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide.

Molecular Properties

Compound Name1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide
PubChem CID22285405
Molecular FormulaC22H23ClN4O2
Molecular Weight410.91 g/mol
Exact Mass410.15
IUPAC Name1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide
SMILESCc1ccc(-c2nc(C(=O)NN3CCOCC3)cn2-c2ccc(Cl)cc2)c(C)c1
InChIInChI=1S/C22H23ClN4O2/c1-15-3-8-19(16(2)13-15)21-24-20(22(28)25-26-9-11-29-12-10-26)14-27(21)18-6-4-17(23)5-7-18/h3-8,13-14H,9-12H2,1-2H3,(H,25,28)
InChIKeyREMBHOUNAHEQSD-UHFFFAOYSA-N
XLogP3.79
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.91
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-chlorophenyl)-2-(2,4-difluorophenyl)-N-morpholin-4-ylimidazole-4-carboxamide
CID 22285377
1-(4-chlorophenyl)-2-(3-methylthiophen-2-yl)-N-piperidin-1-ylimidazole-4-carboxamide
CID 163932545
1-(4-chlorophenyl)-2-(4-methylphenyl)imidazole-4-carboxylic acid
CID 94946709
2-(2,4-dichlorophenyl)-1-(4-methylphenyl)-N-morpholin-4-yl-5-(pyrrolidin-1-ylmethyl)imidazole-4-carboxamide
CID 91349772
2-bromo-1-[1-(4-chlorophenyl)-2-(2,4-dichlorophenyl)imidazol-4-yl]ethanone
CID 86592993
1-(4-chlorophenyl)-2-(2,4-dichlorophenyl)-N'-methyl-N'-phenylimidazole-4-carbohydrazide
CID 163957647
2-(4-chlorophenyl)-1-(2,4-dimethylphenyl)imidazole-4-carboxylic acid
CID 82212267
5-chloro-2-(methylamino)-N-morpholin-4-ylbenzamide
CID 83023895
2-(2-chlorophenyl)-1-(4-chlorophenyl)-N-ethylsulfonylimidazole-4-carboxamide
CID 155116204
1-(4-chlorophenyl)-N-methyl-2-(4-methylsulfonylphenyl)imidazole-4-carboxamide
CID 54379362
2-[2-(aminomethyl)phenyl]-1-(4-chlorophenyl)-N-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]imidazole-4-carboxamide
CID 174460654
2-(2-methylphenyl)-1-(3-methylphenyl)imidazole-4-carboxylic acid
CID 82212289

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide?
The IUPAC name of 1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide (CID 22285405) is 1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide.
What is the SMILES notation for 1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide?
The canonical SMILES for 1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide is Cc1ccc(-c2nc(C(=O)NN3CCOCC3)cn2-c2ccc(Cl)cc2)c(C)c1.
What is the InChIKey of 1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide?
The InChIKey is REMBHOUNAHEQSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23ClN4O2/c1-15-3-8-19(16(2)13-15)21-24-20(22(28)25-26-9-11-29-12-10-26)14-27(21)18-6-4-17(23)5-7-18/h3-8,13-14H,9-12H2,1-2H3,(H,25,28).
What are the key properties of 1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide?
1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide has a molecular weight of 410.91 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-2-(2,4-dimethylphenyl)-N-morpholin-4-ylimidazole-4-carboxamide is sourced from PubChem (CID 22285405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).