2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide

C16H15ClFNO — CID 60592550

IUPAC2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide
SMILESCCN(C(=O)Cc1ccccc1Cl)c1ccc(F)cc1
InChIInChI=1S/C16H15ClFNO/c1-2-19(14-9-7-13(18)8-10-14)16(20)11-12-5-3-4-6-15(12)17/h3-10H,2,11H2,1H3
InChIKeyBKOQGPZKYIFMPY-UHFFFAOYSA-N
MW291.75 g/mol
LogP4.07
Rot. Bonds4

About 2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide

2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide (PubChem CID 60592550) has the molecular formula C16H15ClFNO and a molecular weight of 291.75 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide
PubChem CID60592550
Molecular FormulaC16H15ClFNO
Molecular Weight291.75 g/mol
Exact Mass291.08
IUPAC Name2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide
SMILESCCN(C(=O)Cc1ccccc1Cl)c1ccc(F)cc1
InChIInChI=1S/C16H15ClFNO/c1-2-19(14-9-7-13(18)8-10-14)16(20)11-12-5-3-4-6-15(12)17/h3-10H,2,11H2,1H3
InChIKeyBKOQGPZKYIFMPY-UHFFFAOYSA-N
XLogP4.07
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.75
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide (CID 60592550) is 2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide is CCN(C(=O)Cc1ccccc1Cl)c1ccc(F)cc1.
What is the InChIKey of 2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide?
The InChIKey is BKOQGPZKYIFMPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClFNO/c1-2-19(14-9-7-13(18)8-10-14)16(20)11-12-5-3-4-6-15(12)17/h3-10H,2,11H2,1H3.
What are the key properties of 2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide?
2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide has a molecular weight of 291.75 g/mol, XLogP of 4.07, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-ethyl-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 60592550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).