2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide

C16H14Cl2FNO2 — CID 110910978

IUPAC2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide
SMILESO=C(Cc1cc(Cl)ccc1Cl)NCC(O)c1ccc(F)cc1
InChIInChI=1S/C16H14Cl2FNO2/c17-12-3-6-14(18)11(7-12)8-16(22)20-9-15(21)10-1-4-13(19)5-2-10/h1-7,15,21H,8-9H2,(H,20,22)
InChIKeyYQKQTZKJHBTKPE-UHFFFAOYSA-N
MW342.20 g/mol
LogP3.52
Rot. Bonds5

About 2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide

2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide (PubChem CID 110910978) has the molecular formula C16H14Cl2FNO2 and a molecular weight of 342.20 g/mol. Its IUPAC name is 2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide.

Molecular Properties

Compound Name2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide
PubChem CID110910978
Molecular FormulaC16H14Cl2FNO2
Molecular Weight342.20 g/mol
Exact Mass341.04
IUPAC Name2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide
SMILESO=C(Cc1cc(Cl)ccc1Cl)NCC(O)c1ccc(F)cc1
InChIInChI=1S/C16H14Cl2FNO2/c17-12-3-6-14(18)11(7-12)8-16(22)20-9-15(21)10-1-4-13(19)5-2-10/h1-7,15,21H,8-9H2,(H,20,22)
InChIKeyYQKQTZKJHBTKPE-UHFFFAOYSA-N
XLogP3.52
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.20
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,5-dichlorophenyl)-3-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]urea
CID 52591003
N-[2-(4-chlorophenyl)-2-hydroxyethyl]-2-(6-fluoro-1H-indol-3-yl)acetamide
CID 110931259
1-(2,4-dichlorophenyl)-3-[2-(4-fluorophenyl)-2-hydroxyethyl]urea
CID 75876358
2-(4-chlorophenyl)sulfanyl-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide
CID 110888960
N-[2-(4-chlorophenyl)-2-hydroxyethyl]-2-(4-fluorophenyl)sulfanylacetamide
CID 110885410
4-chloro-N-[2-(4-chlorophenyl)-2-hydroxyethyl]-2-fluorobenzamide
CID 167783306
2,4-difluoro-N-[2-(4-fluorophenyl)-2-hydroxyethyl]benzamide
CID 110888862
N-[2-(4-chlorophenyl)-2-hydroxyethyl]-1-(4-fluorophenyl)cyclopropane-1-carboxamide
CID 110437937
2-(2-chlorophenyl)-N-[2-hydroxy-2-(4-methylsulfanylphenyl)ethyl]acetamide
CID 90581804
2-(2,5-dichlorophenyl)-1-(4-fluorophenyl)ethanone
CID 65316679
N-[2-(4-chlorophenyl)-2-hydroxyethyl]-2-methylpropanamide
CID 82117612
2-[2-(2,4-dichlorophenyl)ethylamino]-1-(4-fluorophenyl)ethanol
CID 60714746

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide?
The IUPAC name of 2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide (CID 110910978) is 2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide.
What is the SMILES notation for 2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide?
The canonical SMILES for 2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide is O=C(Cc1cc(Cl)ccc1Cl)NCC(O)c1ccc(F)cc1.
What is the InChIKey of 2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide?
The InChIKey is YQKQTZKJHBTKPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2FNO2/c17-12-3-6-14(18)11(7-12)8-16(22)20-9-15(21)10-1-4-13(19)5-2-10/h1-7,15,21H,8-9H2,(H,20,22).
What are the key properties of 2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide?
2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide has a molecular weight of 342.20 g/mol, XLogP of 3.52, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenyl)-N-[2-(4-fluorophenyl)-2-hydroxyethyl]acetamide is sourced from PubChem (CID 110910978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).