N-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide

C16H15Cl2FN2O — CID 2574151

IUPACN-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide
SMILESCN(CC(=O)Nc1cccc(Cl)c1Cl)Cc1cccc(F)c1
InChIInChI=1S/C16H15Cl2FN2O/c1-21(9-11-4-2-5-12(19)8-11)10-15(22)20-14-7-3-6-13(17)16(14)18/h2-8H,9-10H2,1H3,(H,20,22)
InChIKeyRXEQWRYIXKHBCG-UHFFFAOYSA-N
MW341.21 g/mol
LogP4.20
Rot. Bonds5

About N-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide

N-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide (PubChem CID 2574151) has the molecular formula C16H15Cl2FN2O and a molecular weight of 341.21 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide
PubChem CID2574151
Molecular FormulaC16H15Cl2FN2O
Molecular Weight341.21 g/mol
Exact Mass340.05
IUPAC NameN-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide
SMILESCN(CC(=O)Nc1cccc(Cl)c1Cl)Cc1cccc(F)c1
InChIInChI=1S/C16H15Cl2FN2O/c1-21(9-11-4-2-5-12(19)8-11)10-15(22)20-14-7-3-6-13(17)16(14)18/h2-8H,9-10H2,1H3,(H,20,22)
InChIKeyRXEQWRYIXKHBCG-UHFFFAOYSA-N
XLogP4.20
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.21
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chlorophenyl)-2-[[2-[(3-fluorophenyl)methyl-methylamino]acetyl]-methylamino]acetamide
CID 25479489
N-(3-fluorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide
CID 9223772
N-(2,3-dichlorophenyl)-2-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl-methylamino]acetamide
CID 16555115
2-[(3-fluorophenyl)methyl-methylamino]-N-(2-nitrophenyl)acetamide
CID 8961830
N-(2,3-dichlorophenyl)-2-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]acetamide
CID 38877263
N-(2,3-dichlorophenyl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide
CID 22196117
N-[2-(2-chloroanilino)-2-oxoethyl]-2-(3-fluorophenyl)-N-methylacetamide
CID 38632222
N-(5-chloro-2-pyridinyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide
CID 86908832
2-[[2-(3-chloro-2-methylanilino)-2-oxoethyl]-methylamino]-N-(3-fluorophenyl)acetamide
CID 2658580
N-(2,3-dichlorophenyl)-2-[3-hydroxypropyl(methyl)amino]acetamide
CID 114230839
2-[(5-chloro-2-methoxyphenyl)methyl-methylamino]-N-(2,3-dichlorophenyl)acetamide
CID 9136519
N-(2,3-dichlorophenyl)-2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]acetamide
CID 9339279

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide (CID 2574151) is N-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide is CN(CC(=O)Nc1cccc(Cl)c1Cl)Cc1cccc(F)c1.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide?
The InChIKey is RXEQWRYIXKHBCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2FN2O/c1-21(9-11-4-2-5-12(19)8-11)10-15(22)20-14-7-3-6-13(17)16(14)18/h2-8H,9-10H2,1H3,(H,20,22).
What are the key properties of N-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide?
N-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide has a molecular weight of 341.21 g/mol, XLogP of 4.20, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide is sourced from PubChem (CID 2574151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).