2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide

C17H13ClFN3O2 — CID 59587669

IUPAC2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide
SMILESCOc1ccc(-c2nc(-c3c(F)cccc3Cl)[nH]c2C(N)=O)cc1
InChIInChI=1S/C17H13ClFN3O2/c1-24-10-7-5-9(6-8-10)14-15(16(20)23)22-17(21-14)13-11(18)3-2-4-12(13)19/h2-8H,1H3,(H2,20,23)(H,21,22)
InChIKeyVDOIMRHQJBGDQA-UHFFFAOYSA-N
MW345.76 g/mol
LogP3.64
Rot. Bonds4

About 2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide

2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide (PubChem CID 59587669) has the molecular formula C17H13ClFN3O2 and a molecular weight of 345.76 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide
PubChem CID59587669
Molecular FormulaC17H13ClFN3O2
Molecular Weight345.76 g/mol
Exact Mass345.07
IUPAC Name2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide
SMILESCOc1ccc(-c2nc(-c3c(F)cccc3Cl)[nH]c2C(N)=O)cc1
InChIInChI=1S/C17H13ClFN3O2/c1-24-10-7-5-9(6-8-10)14-15(16(20)23)22-17(21-14)13-11(18)3-2-4-12(13)19/h2-8H,1H3,(H2,20,23)(H,21,22)
InChIKeyVDOIMRHQJBGDQA-UHFFFAOYSA-N
XLogP3.64
TPSA81.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.76
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide
CID 59587398
2-(2-chloro-6-fluorophenyl)-4-(6-phenyl-3-pyridinyl)-1H-imidazole-5-carboxylic acid
CID 70833482
4-[5-bromo-2-(2-chloro-6-fluorophenyl)-1H-imidazol-4-yl]benzoic acid
CID 69189659
ethyl 4-(4-methoxyphenyl)-2-phenyl-1H-imidazole-5-carboxylate
CID 44605731
4-(2-chloro-6-fluorophenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine
CID 75359612
3-(2-chloro-6-fluorophenyl)-5-(4-methoxyphenyl)-1-methyl-1,2,4-triazole
CID 18995923
2-[1-[(4-chloro-3-fluorophenyl)methyl]piperidin-4-yl]-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide
CID 110092686
4-(2,3-dichlorophenyl)-2-(4-methoxyphenyl)-5-methyl-1H-imidazole
CID 73332044
4-amino-5-(2,6-difluorobenzoyl)-2-(4-methoxyphenyl)-1H-pyrrole-3-carboxamide
CID 46224969
3-chloro-2-(4-methoxyphenyl)phenol
CID 101453528
[2-(2-chloro-6-fluorophenyl)-5-methyl-1H-imidazol-4-yl]methanamine
CID 82292580
7-chloro-2-(2-chloro-6-fluorophenyl)-N-[1-(3-methoxyphenyl)ethyl]-3H-benzimidazole-5-carboxamide
CID 53357037

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide (CID 59587669) is 2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide is COc1ccc(-c2nc(-c3c(F)cccc3Cl)[nH]c2C(N)=O)cc1.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide?
The InChIKey is VDOIMRHQJBGDQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClFN3O2/c1-24-10-7-5-9(6-8-10)14-15(16(20)23)22-17(21-14)13-11(18)3-2-4-12(13)19/h2-8H,1H3,(H2,20,23)(H,21,22).
What are the key properties of 2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide?
2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide has a molecular weight of 345.76 g/mol, XLogP of 3.64, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-4-(4-methoxyphenyl)-1H-imidazole-5-carboxamide is sourced from PubChem (CID 59587669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).