N-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide

C17H15Cl2N3O — CID 7755761

IUPACN-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide
SMILESCc1ccc(Cl)c(NC(=O)Cn2c(C)nc3ccccc32)c1Cl
InChIInChI=1S/C17H15Cl2N3O/c1-10-7-8-12(18)17(16(10)19)21-15(23)9-22-11(2)20-13-5-3-4-6-14(13)22/h3-8H,9H2,1-2H3,(H,21,23)
InChIKeyOSTLPQIJEWQEGN-UHFFFAOYSA-N
MW348.23 g/mol
LogP4.60
Rot. Bonds3

About N-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide

N-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide (PubChem CID 7755761) has the molecular formula C17H15Cl2N3O and a molecular weight of 348.23 g/mol. Its IUPAC name is N-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide
PubChem CID7755761
Molecular FormulaC17H15Cl2N3O
Molecular Weight348.23 g/mol
Exact Mass347.06
IUPAC NameN-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide
SMILESCc1ccc(Cl)c(NC(=O)Cn2c(C)nc3ccccc32)c1Cl
InChIInChI=1S/C17H15Cl2N3O/c1-10-7-8-12(18)17(16(10)19)21-15(23)9-22-11(2)20-13-5-3-4-6-14(13)22/h3-8H,9H2,1-2H3,(H,21,23)
InChIKeyOSTLPQIJEWQEGN-UHFFFAOYSA-N
XLogP4.60
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.23
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(benzotriazol-1-yl)-N-(2,6-dichloro-3-methylphenyl)acetamide
CID 7504195
N-(5-chloro-2-pyridinyl)-2-(2-methylbenzimidazol-1-yl)acetamide
CID 40688756
N-(4-iodophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide
CID 7755726
N-(2-acetamidoethyl)-2-(2-methylbenzimidazol-1-yl)acetamide
CID 47131203
2-[2-(4-chlorophenyl)benzimidazol-1-yl]-N-(2,6-dimethylphenyl)acetamide
CID 17033143
2-(2-methylbenzimidazol-1-yl)acetic acid
CID 75530217
N'-[2-(2-methylbenzimidazol-1-yl)acetyl]-2-(2-methylphenyl)acetohydrazide
CID 127044969
methyl 2-[[2-(2-methylbenzimidazol-1-yl)acetyl]amino]benzoate
CID 18166122
N-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide
CID 40689130
N-[(Z)-(2,6-dichlorophenyl)methylideneamino]-2-(2-methylbenzimidazol-1-yl)acetamide
CID 9121440
N-cyclopropyl-2-(2-methylbenzimidazol-1-yl)acetamide
CID 7755737
2-(2-methylbenzimidazol-1-yl)-N-(4-nitrophenyl)acetamide
CID 7755868

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide?
The IUPAC name of N-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide (CID 7755761) is N-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide.
What is the SMILES notation for N-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide?
The canonical SMILES for N-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide is Cc1ccc(Cl)c(NC(=O)Cn2c(C)nc3ccccc32)c1Cl.
What is the InChIKey of N-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide?
The InChIKey is OSTLPQIJEWQEGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15Cl2N3O/c1-10-7-8-12(18)17(16(10)19)21-15(23)9-22-11(2)20-13-5-3-4-6-14(13)22/h3-8H,9H2,1-2H3,(H,21,23).
What are the key properties of N-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide?
N-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide has a molecular weight of 348.23 g/mol, XLogP of 4.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichloro-3-methylphenyl)-2-(2-methylbenzimidazol-1-yl)acetamide is sourced from PubChem (CID 7755761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).