N-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide

C15H12Cl2FNO — CID 166226019

IUPACN-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)NCc1ccc(Cl)cc1F
InChIInChI=1S/C15H12Cl2FNO/c16-12-4-1-10(2-5-12)7-15(20)19-9-11-3-6-13(17)8-14(11)18/h1-6,8H,7,9H2,(H,19,20)
InChIKeyCEWCNKBUKJXKMP-UHFFFAOYSA-N
MW312.17 g/mol
LogP3.99
Rot. Bonds4

About N-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide

N-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide (PubChem CID 166226019) has the molecular formula C15H12Cl2FNO and a molecular weight of 312.17 g/mol. Its IUPAC name is N-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide.

Molecular Properties

Compound NameN-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide
PubChem CID166226019
Molecular FormulaC15H12Cl2FNO
Molecular Weight312.17 g/mol
Exact Mass311.03
IUPAC NameN-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)NCc1ccc(Cl)cc1F
InChIInChI=1S/C15H12Cl2FNO/c16-12-4-1-10(2-5-12)7-15(20)19-9-11-3-6-13(17)8-14(11)18/h1-6,8H,7,9H2,(H,19,20)
InChIKeyCEWCNKBUKJXKMP-UHFFFAOYSA-N
XLogP3.99
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.17
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-chloro-4-fluorophenyl)-N-[(4-chloro-2-fluorophenyl)methyl]acetamide
CID 166226023
N-benzyl-2-(4-chloro-2-fluorophenyl)acetamide
CID 56920126
N-[(4-chlorophenyl)methyl]-2-(2,4-dichlorophenyl)acetamide
CID 1226021
N-[(4-chloro-2-fluorophenyl)methyl]-2-(2-methoxyethoxy)acetamide
CID 110482951
2-[2-[(4-chloro-2-fluorophenyl)methylamino]-2-oxoethoxy]acetic acid
CID 110482879
2-(4-chlorophenyl)-N-[(3-fluorophenyl)methyl]acetamide
CID 47161047
2-(4-chloro-2-fluorophenyl)acetohydrazide
CID 162677805
2-(4-chlorophenyl)-N-[(3-fluoro-4-methoxyphenyl)methyl]acetamide
CID 110779980
N-[(2,4-difluorophenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 110782201
2-(4-chlorophenyl)-N-[(4-methylsulfanylphenyl)methyl]acetamide
CID 47380839
N-[(2,4-dichlorophenyl)methyl]-2-(3-fluoro-4-methoxyphenyl)acetamide
CID 9045958
3-(4-chlorophenyl)-N-[(2-fluorophenyl)methyl]propanamide
CID 41499879

Frequently Asked Questions

What is the IUPAC name of N-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide?
The IUPAC name of N-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide (CID 166226019) is N-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide.
What is the SMILES notation for N-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide?
The canonical SMILES for N-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide is O=C(Cc1ccc(Cl)cc1)NCc1ccc(Cl)cc1F.
What is the InChIKey of N-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide?
The InChIKey is CEWCNKBUKJXKMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2FNO/c16-12-4-1-10(2-5-12)7-15(20)19-9-11-3-6-13(17)8-14(11)18/h1-6,8H,7,9H2,(H,19,20).
What are the key properties of N-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide?
N-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide has a molecular weight of 312.17 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chloro-2-fluorophenyl)methyl]-2-(4-chlorophenyl)acetamide is sourced from PubChem (CID 166226019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).