N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide

C9H7ClF3NO — CID 6461606

IUPACN-[4-chloro-2-(trifluoromethyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(Cl)cc1C(F)(F)F
InChIInChI=1S/C9H7ClF3NO/c1-5(15)14-8-3-2-6(10)4-7(8)9(11,12)13/h2-4H,1H3,(H,14,15)
InChIKeyIZNOWIFMPCHWNZ-UHFFFAOYSA-N
MW237.61 g/mol
LogP3.32
Rot. Bonds1

About N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide

N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide (PubChem CID 6461606) has the molecular formula C9H7ClF3NO and a molecular weight of 237.61 g/mol. Its IUPAC name is N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-chloro-2-(trifluoromethyl)phenyl]acetamide
PubChem CID6461606
Molecular FormulaC9H7ClF3NO
Molecular Weight237.61 g/mol
Exact Mass237.02
IUPAC NameN-[4-chloro-2-(trifluoromethyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(Cl)cc1C(F)(F)F
InChIInChI=1S/C9H7ClF3NO/c1-5(15)14-8-3-2-6(10)4-7(8)9(11,12)13/h2-4H,1H3,(H,14,15)
InChIKeyIZNOWIFMPCHWNZ-UHFFFAOYSA-N
XLogP3.32
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.61
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-Chloro-4-acetotoluidide
CID 23537
N-(4-Chlorophenyl)acetamide
CID 10871
N-[2-(trifluoromethyl)phenyl]acetamide
CID 67655
8-chloroquinolin-2(1H)-one
CID 4204917
Butanamide, N-(4-chloro-2-methylphenyl)-3-oxo-
CID 258549
N-(4-chloro-2-(trifluoromethyl)phenyl)-2-propoxy-acetamide
CID 15708953
N-(3-chlorophenyl)-2,2,2-trifluoroacetamide
CID 532127
N-(2-chloro-4-(trifluoromethyl)phenyl)acetamide
CID 2736671
6-Chloro-4-methylquinolin-2(1H)-one
CID 606322
Fasentin
CID 879520
N-(4-Chloro-2-methyl-phenyl)-2-pyrrolidin-1-yl-acetamide
CID 6493742
Acetamide, N-(4-chloro-2-methylphenyl)-2-(hydroxyimino)-
CID 9580351

Frequently Asked Questions

What is the IUPAC name of N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide (CID 6461606) is N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide is CC(=O)Nc1ccc(Cl)cc1C(F)(F)F.
What is the InChIKey of N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide?
The InChIKey is IZNOWIFMPCHWNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClF3NO/c1-5(15)14-8-3-2-6(10)4-7(8)9(11,12)13/h2-4H,1H3,(H,14,15).
What are the key properties of N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide?
N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide has a molecular weight of 237.61 g/mol, XLogP of 3.32, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 6461606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).