N-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide

C18H15Cl2N3O — CID 15733135

IUPACN-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide
SMILESCC(=O)Nn1cc(-c2ccc(Cl)cc2Cl)nc1Cc1ccccc1
InChIInChI=1S/C18H15Cl2N3O/c1-12(24)22-23-11-17(15-8-7-14(19)10-16(15)20)21-18(23)9-13-5-3-2-4-6-13/h2-8,10-11H,9H2,1H3,(H,22,24)
InChIKeyPPUJGBMDOVPXCH-UHFFFAOYSA-N
MW360.24 g/mol
LogP4.54
Rot. Bonds4

About N-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide

N-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide (PubChem CID 15733135) has the molecular formula C18H15Cl2N3O and a molecular weight of 360.24 g/mol. Its IUPAC name is N-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide
PubChem CID15733135
Molecular FormulaC18H15Cl2N3O
Molecular Weight360.24 g/mol
Exact Mass359.06
IUPAC NameN-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide
SMILESCC(=O)Nn1cc(-c2ccc(Cl)cc2Cl)nc1Cc1ccccc1
InChIInChI=1S/C18H15Cl2N3O/c1-12(24)22-23-11-17(15-8-7-14(19)10-16(15)20)21-18(23)9-13-5-3-2-4-6-13/h2-8,10-11H,9H2,1H3,(H,22,24)
InChIKeyPPUJGBMDOVPXCH-UHFFFAOYSA-N
XLogP4.54
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.24
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-4-(2,4-dichlorophenyl)-2-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]imidazole
CID 141094182
4-[[4-(2,4-dichlorophenyl)-2-[[4-[4-(fluoromethyl)phenyl]phenyl]methyl]imidazol-1-yl]methyl]benzoic acid
CID 143094792
4-[[2-[[4-(3-aminophenyl)phenyl]methyl]-4-(2,4-dichlorophenyl)imidazol-1-yl]methyl]benzoic acid
CID 141121313
2-[4-[4-[[4-(2,4-dichlorophenyl)-1-ethylimidazol-2-yl]methyl]phenyl]phenoxy]-2-(4-fluorophenyl)acetic acid
CID 58231248
2-amino-3-benzylsulfonyl-4-[4-[4-[[4-(2,4-dichlorophenyl)-1-ethylimidazol-2-yl]methyl]phenyl]phenoxy]benzoic acid
CID 67117891
1,2-dibenzyl-6-chlorobenzimidazole
CID 46311010
5-[4-(2,4-dichlorophenyl)-2-[[4-(4-hydroxyphenyl)phenyl]methyl]imidazol-1-yl]-2-(trifluoromethyl)benzoic acid
CID 52918806
ethyl 2-benzyl-3-[(2,4-dichlorophenyl)methyl]benzimidazole-5-carboxylate
CID 18315443
4-(2,4-dichlorophenyl)-1-ethyl-2-[(E)-1-(4-phenylphenyl)prop-1-en-2-yl]imidazole
CID 141094170
methyl 4-[[2-[[3-[(4-butylphenyl)sulfonylamino]phenyl]methyl]-4-(2,4-dichlorophenyl)imidazol-1-yl]methyl]benzoate
CID 58231311
4,5-bis(2,4-dichlorophenyl)-N-(2-phenylethyl)triazole-2-carboxamide
CID 59363153
methyl 2-[4-[4-(2,4-dichlorophenyl)-2-[(6-methoxynaphthalen-2-yl)methyl]imidazol-1-yl]anilino]acetate
CID 68583797

Frequently Asked Questions

What is the IUPAC name of N-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide?
The IUPAC name of N-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide (CID 15733135) is N-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide.
What is the SMILES notation for N-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide?
The canonical SMILES for N-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide is CC(=O)Nn1cc(-c2ccc(Cl)cc2Cl)nc1Cc1ccccc1.
What is the InChIKey of N-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide?
The InChIKey is PPUJGBMDOVPXCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15Cl2N3O/c1-12(24)22-23-11-17(15-8-7-14(19)10-16(15)20)21-18(23)9-13-5-3-2-4-6-13/h2-8,10-11H,9H2,1H3,(H,22,24).
What are the key properties of N-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide?
N-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide has a molecular weight of 360.24 g/mol, XLogP of 4.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-benzyl-4-(2,4-dichlorophenyl)imidazol-1-yl]acetamide is sourced from PubChem (CID 15733135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).