2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide

C17H16Cl2N2O2 — CID 3521204

IUPAC2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide
SMILESCc1cccc(C)c1NC(=O)C(NC=O)c1ccc(Cl)cc1Cl
InChIInChI=1S/C17H16Cl2N2O2/c1-10-4-3-5-11(2)15(10)21-17(23)16(20-9-22)13-7-6-12(18)8-14(13)19/h3-9,16H,1-2H3,(H,20,22)(H,21,23)
InChIKeyGQGUZARRGVHMTE-UHFFFAOYSA-N
MW351.23 g/mol
LogP4.04
Rot. Bonds5

About 2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide

2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide (PubChem CID 3521204) has the molecular formula C17H16Cl2N2O2 and a molecular weight of 351.23 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide
PubChem CID3521204
Molecular FormulaC17H16Cl2N2O2
Molecular Weight351.23 g/mol
Exact Mass350.06
IUPAC Name2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide
SMILESCc1cccc(C)c1NC(=O)C(NC=O)c1ccc(Cl)cc1Cl
InChIInChI=1S/C17H16Cl2N2O2/c1-10-4-3-5-11(2)15(10)21-17(23)16(20-9-22)13-7-6-12(18)8-14(13)19/h3-9,16H,1-2H3,(H,20,22)(H,21,23)
InChIKeyGQGUZARRGVHMTE-UHFFFAOYSA-N
XLogP4.04
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.23
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-piperidin-1-ylacetamide
CID 3108201
2-[[(1S)-1-(2,4-dichlorophenyl)ethyl]amino]-N-[2-(2,6-dimethylanilino)-2-oxoethyl]acetamide
CID 9253824
(2S)-2-(2,4-dichlorophenoxy)-N-(2,6-dimethylphenyl)propanamide
CID 6922800
N-(2,6-dimethylphenyl)-2-formamido-2-(4-hydroxy-3-methoxyphenyl)acetamide
CID 4593720
4-chloro-2-[(2,6-dimethylphenyl)carbamoylamino]benzoic acid
CID 58994734
(2S)-2-(2,4-dichlorophenyl)-2-[[2-(1,3-dioxoisoindol-2-yl)acetyl]amino]-N-(2-methylphenyl)acetamide
CID 7037753
2-(2,4-dichlorophenyl)-N-[2-(2,6-dimethylanilino)-2-oxoethyl]acetamide
CID 7676714
N-(2,6-dimethylphenyl)-2-methylpropanamide;yttrium
CID 158388394
(2R)-2-[(2,5-dichlorophenyl)sulfonylamino]-N-(2,6-dimethylphenyl)propanamide
CID 124549696
1-[(2,4-dichlorophenoxy)methyl]-3-(2,6-dimethylphenyl)urea
CID 108881118
(E)-1-(2,4-dichlorophenyl)-3-(2,6-dimethylanilino)prop-2-en-1-one
CID 2244087
2,4-dichloro-N-[(2,6-dimethylphenyl)carbamothioyl]benzamide
CID 1342825

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide?
The IUPAC name of 2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide (CID 3521204) is 2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide?
The canonical SMILES for 2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide is Cc1cccc(C)c1NC(=O)C(NC=O)c1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide?
The InChIKey is GQGUZARRGVHMTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16Cl2N2O2/c1-10-4-3-5-11(2)15(10)21-17(23)16(20-9-22)13-7-6-12(18)8-14(13)19/h3-9,16H,1-2H3,(H,20,22)(H,21,23).
What are the key properties of 2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide?
2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide has a molecular weight of 351.23 g/mol, XLogP of 4.04, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-N-(2,6-dimethylphenyl)-2-formamidoacetamide is sourced from PubChem (CID 3521204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).