N-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide

C9H8ClF3N2O2 — CID 86997957

IUPACN-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide
SMILESO=C(COCC(F)(F)F)Nc1ccc(Cl)cn1
InChIInChI=1S/C9H8ClF3N2O2/c10-6-1-2-7(14-3-6)15-8(16)4-17-5-9(11,12)13/h1-3H,4-5H2,(H,14,15,16)
InChIKeyHDSBMHCUFZGWGG-UHFFFAOYSA-N
MW268.62 g/mol
LogP2.25
Rot. Bonds4

About N-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide

N-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide (PubChem CID 86997957) has the molecular formula C9H8ClF3N2O2 and a molecular weight of 268.62 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide
PubChem CID86997957
Molecular FormulaC9H8ClF3N2O2
Molecular Weight268.62 g/mol
Exact Mass268.02
IUPAC NameN-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide
SMILESO=C(COCC(F)(F)F)Nc1ccc(Cl)cn1
InChIInChI=1S/C9H8ClF3N2O2/c10-6-1-2-7(14-3-6)15-8(16)4-17-5-9(11,12)13/h1-3H,4-5H2,(H,14,15,16)
InChIKeyHDSBMHCUFZGWGG-UHFFFAOYSA-N
XLogP2.25
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.62
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)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-(5-bromo-4-methyl-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 103738091
N-(5-piperazin-1-yl-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 119494193
N-(5-chloro-2-pyridinyl)-2-(4-ethoxyphenoxy)acetamide
CID 34135089
[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl] 2-(2,4-dichlorophenyl)acetate
CID 2450474
N-(5-chloro-2-pyridinyl)-2-(3-fluorophenoxy)acetamide
CID 33327531
[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl] 2,4-dichlorobenzoate
CID 7873014
6-[3-(2,2,2-trifluoroethoxy)propanoylamino]pyridine-3-carboxylic acid
CID 61317563
[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl] 2,4-difluorobenzoate
CID 2554738
N-(5-chloro-2-pyridinyl)-2-[4-(difluoromethoxy)phenyl]acetamide
CID 34136582
[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl] (E)-3-[4-(trifluoromethoxy)phenyl]prop-2-enoate
CID 46793180
[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl] 2-naphthalen-1-ylacetate
CID 2079261
N-(5-chloro-2-pyridinyl)-2-[3-hydroxypropyl(2,2,2-trifluoroethyl)amino]acetamide
CID 111022260

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide (CID 86997957) is N-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide is O=C(COCC(F)(F)F)Nc1ccc(Cl)cn1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide?
The InChIKey is HDSBMHCUFZGWGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClF3N2O2/c10-6-1-2-7(14-3-6)15-8(16)4-17-5-9(11,12)13/h1-3H,4-5H2,(H,14,15,16).
What are the key properties of N-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide?
N-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide has a molecular weight of 268.62 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-2-(2,2,2-trifluoroethoxy)acetamide is sourced from PubChem (CID 86997957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).