N-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide

C16H15ClFNO — CID 7048973

IUPACN-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide
SMILESO=C(Cc1ccccc1F)NCCc1cccc(Cl)c1
InChIInChI=1S/C16H15ClFNO/c17-14-6-3-4-12(10-14)8-9-19-16(20)11-13-5-1-2-7-15(13)18/h1-7,10H,8-9,11H2,(H,19,20)
InChIKeyFNVGRZLBJHPODG-UHFFFAOYSA-N
MW291.75 g/mol
LogP3.38
Rot. Bonds5

About N-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide

N-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide (PubChem CID 7048973) has the molecular formula C16H15ClFNO and a molecular weight of 291.75 g/mol. Its IUPAC name is N-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide
PubChem CID7048973
Molecular FormulaC16H15ClFNO
Molecular Weight291.75 g/mol
Exact Mass291.08
IUPAC NameN-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide
SMILESO=C(Cc1ccccc1F)NCCc1cccc(Cl)c1
InChIInChI=1S/C16H15ClFNO/c17-14-6-3-4-12(10-14)8-9-19-16(20)11-13-5-1-2-7-15(13)18/h1-7,10H,8-9,11H2,(H,19,20)
InChIKeyFNVGRZLBJHPODG-UHFFFAOYSA-N
XLogP3.38
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.75
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide?
The IUPAC name of N-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide (CID 7048973) is N-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide.
What is the SMILES notation for N-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide?
The canonical SMILES for N-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide is O=C(Cc1ccccc1F)NCCc1cccc(Cl)c1.
What is the InChIKey of N-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide?
The InChIKey is FNVGRZLBJHPODG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClFNO/c17-14-6-3-4-12(10-14)8-9-19-16(20)11-13-5-1-2-7-15(13)18/h1-7,10H,8-9,11H2,(H,19,20).
What are the key properties of N-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide?
N-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide has a molecular weight of 291.75 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-chlorophenyl)ethyl]-2-(2-fluorophenyl)acetamide is sourced from PubChem (CID 7048973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).