2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide

C16H13Cl2N3O2 — CID 35280310

IUPAC2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide
SMILESCn1c(NC(=O)COc2ccc(Cl)cc2Cl)nc2ccccc21
InChIInChI=1S/C16H13Cl2N3O2/c1-21-13-5-3-2-4-12(13)19-16(21)20-15(22)9-23-14-7-6-10(17)8-11(14)18/h2-8H,9H2,1H3,(H,19,20,22)
InChIKeyCSHVZINPJDEUAG-UHFFFAOYSA-N
MW350.21 g/mol
LogP3.90
Rot. Bonds4

About 2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide

2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide (PubChem CID 35280310) has the molecular formula C16H13Cl2N3O2 and a molecular weight of 350.21 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide
PubChem CID35280310
Molecular FormulaC16H13Cl2N3O2
Molecular Weight350.21 g/mol
Exact Mass349.04
IUPAC Name2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide
SMILESCn1c(NC(=O)COc2ccc(Cl)cc2Cl)nc2ccccc21
InChIInChI=1S/C16H13Cl2N3O2/c1-21-13-5-3-2-4-12(13)19-16(21)20-15(22)9-23-14-7-6-10(17)8-11(14)18/h2-8H,9H2,1H3,(H,19,20,22)
InChIKeyCSHVZINPJDEUAG-UHFFFAOYSA-N
XLogP3.90
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.21
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-aminobenzimidazol-1-yl)-2-(2,4-dichlorophenoxy)ethanone
CID 17384308
3-(2,4-dichlorophenyl)-N-(1-methylbenzimidazol-2-yl)-1H-pyrazole-5-carboxamide
CID 19509973
2-(2,4-dichlorophenoxy)-N-pyridin-2-ylacetamide
CID 792334
N-(2-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 744320
1-[(2-bromo-4-chlorophenoxy)methyl]-N-(1-methylbenzimidazol-2-yl)pyrazole-3-carboxamide
CID 19274404
2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide
CID 2198238
N-(4-acetamidophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 1039828
2-(2,4-dichlorophenoxy)-N-(4-hydroxyphenyl)acetamide
CID 976414
2-(2,4-dichlorophenoxy)-N-[(3-methyl-1,3-benzothiazol-2-ylidene)amino]acetamide
CID 4054497
1-(benzotriazol-1-yl)-2-(2,4-dichlorophenoxy)ethanone
CID 2321100
potassium 2-(2,4-dichlorophenoxy)-N-oxidoacetamide
CID 23697377
N-[2-[acetyl(methyl)amino]phenyl]-2-(2,4-dichlorophenoxy)acetamide
CID 113093774

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide (CID 35280310) is 2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide is Cn1c(NC(=O)COc2ccc(Cl)cc2Cl)nc2ccccc21.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide?
The InChIKey is CSHVZINPJDEUAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13Cl2N3O2/c1-21-13-5-3-2-4-12(13)19-16(21)20-15(22)9-23-14-7-6-10(17)8-11(14)18/h2-8H,9H2,1H3,(H,19,20,22).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide?
2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide has a molecular weight of 350.21 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide is sourced from PubChem (CID 35280310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).