N-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide

C14H10Cl2F2N2O — CID 62056351

IUPACN-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide
SMILESNc1cc(NC(=O)Cc2ccc(Cl)c(Cl)c2)c(F)cc1F
InChIInChI=1S/C14H10Cl2F2N2O/c15-8-2-1-7(3-9(8)16)4-14(21)20-13-6-12(19)10(17)5-11(13)18/h1-3,5-6H,4,19H2,(H,20,21)
InChIKeyCLUXOLHYZMPKLP-UHFFFAOYSA-N
MW331.15 g/mol
LogP4.03
Rot. Bonds3

About N-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide

N-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide (PubChem CID 62056351) has the molecular formula C14H10Cl2F2N2O and a molecular weight of 331.15 g/mol. Its IUPAC name is N-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide.

Molecular Properties

Compound NameN-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide
PubChem CID62056351
Molecular FormulaC14H10Cl2F2N2O
Molecular Weight331.15 g/mol
Exact Mass330.01
IUPAC NameN-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide
SMILESNc1cc(NC(=O)Cc2ccc(Cl)c(Cl)c2)c(F)cc1F
InChIInChI=1S/C14H10Cl2F2N2O/c15-8-2-1-7(3-9(8)16)4-14(21)20-13-6-12(19)10(17)5-11(13)18/h1-3,5-6H,4,19H2,(H,20,21)
InChIKeyCLUXOLHYZMPKLP-UHFFFAOYSA-N
XLogP4.03
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.15
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-aminophenyl)-2-(3,4-dichlorophenyl)acetamide
CID 63045267
N-(2-amino-4-chlorophenyl)-2-(3,4-dichlorophenyl)acetamide
CID 63045441
N-(4-amino-2-methylphenyl)-2-(3,4-dichlorophenyl)acetamide
CID 63045442
N-(4-bromo-2,6-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide
CID 65498948
2-(4-aminophenyl)-N-(5-chloro-2-fluorophenyl)acetamide
CID 43438160
2-(3,4-dichlorophenyl)-N-(2-methylphenyl)acetamide
CID 2599145
N-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide
CID 63046307
1-(2-amino-3-fluorophenyl)-2-(3,4-dichlorophenyl)ethanone
CID 116597538
2-(4-fluorophenyl)-N-(2,4,5-trichlorophenyl)acetamide
CID 797745
N-(2-amino-6-bromo-4-methylphenyl)-2-(3,4-dichlorophenyl)acetamide
CID 116813505
2-(3,4-dichlorophenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 7492195
N-(2-chloro-5-methyl-3-pyridinyl)-2-(3,4-dichlorophenyl)acetamide
CID 102979634

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide?
The IUPAC name of N-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide (CID 62056351) is N-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide.
What is the SMILES notation for N-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide?
The canonical SMILES for N-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide is Nc1cc(NC(=O)Cc2ccc(Cl)c(Cl)c2)c(F)cc1F.
What is the InChIKey of N-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide?
The InChIKey is CLUXOLHYZMPKLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2F2N2O/c15-8-2-1-7(3-9(8)16)4-14(21)20-13-6-12(19)10(17)5-11(13)18/h1-3,5-6H,4,19H2,(H,20,21).
What are the key properties of N-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide?
N-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide has a molecular weight of 331.15 g/mol, XLogP of 4.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2,4-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide is sourced from PubChem (CID 62056351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).