N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide

C18H17ClF3NO2 — CID 19172179

IUPACN-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide
SMILESCCCc1ccc(OCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc1
InChIInChI=1S/C18H17ClF3NO2/c1-2-3-12-4-7-14(8-5-12)25-11-17(24)23-16-10-13(18(20,21)22)6-9-15(16)19/h4-10H,2-3,11H2,1H3,(H,23,24)
InChIKeyJWZCBRNNDGHJRJ-UHFFFAOYSA-N
MW371.79 g/mol
LogP5.33
Rot. Bonds6

About N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide

N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide (PubChem CID 19172179) has the molecular formula C18H17ClF3NO2 and a molecular weight of 371.79 g/mol. Its IUPAC name is N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide.

Molecular Properties

Compound NameN-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide
PubChem CID19172179
Molecular FormulaC18H17ClF3NO2
Molecular Weight371.79 g/mol
Exact Mass371.09
IUPAC NameN-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide
SMILESCCCc1ccc(OCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc1
InChIInChI=1S/C18H17ClF3NO2/c1-2-3-12-4-7-14(8-5-12)25-11-17(24)23-16-10-13(18(20,21)22)6-9-15(16)19/h4-10H,2-3,11H2,1H3,(H,23,24)
InChIKeyJWZCBRNNDGHJRJ-UHFFFAOYSA-N
XLogP5.33
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.79
LogP ≤ 55.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)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

N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propan-2-ylphenoxy)acetamide
CID 1184428
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[4-[ethyl(methylsulfonyl)amino]phenoxy]acetamide
CID 92649043
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(3-methylphenoxy)acetamide
CID 747189
2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
CID 126397966
N-(2-bromo-4-tert-butylphenyl)-2-(4-propylphenoxy)acetamide
CID 53268422
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide
CID 5139046
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(4-propylphenoxy)acetamide
CID 19174228
2-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethoxy]acetate
CID 7407565
N-(5-acetamido-2-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 55915573
N-(3,5-dichlorophenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 7467602
[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl] 3-phenoxypropanoate
CID 7841537
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-cyano-2-methoxyphenoxy)acetamide
CID 7252185

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide?
The IUPAC name of N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide (CID 19172179) is N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide.
What is the SMILES notation for N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide?
The canonical SMILES for N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide is CCCc1ccc(OCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc1.
What is the InChIKey of N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide?
The InChIKey is JWZCBRNNDGHJRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClF3NO2/c1-2-3-12-4-7-14(8-5-12)25-11-17(24)23-16-10-13(18(20,21)22)6-9-15(16)19/h4-10H,2-3,11H2,1H3,(H,23,24).
What are the key properties of N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide?
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide has a molecular weight of 371.79 g/mol, XLogP of 5.33, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-propylphenoxy)acetamide is sourced from PubChem (CID 19172179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).