2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide

C14H9ClF4N2O — CID 3299281

IUPAC2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ncc(C(F)(F)F)cc1Cl)Nc1ccc(F)cc1
InChIInChI=1S/C14H9ClF4N2O/c15-11-5-8(14(17,18)19)7-20-12(11)6-13(22)21-10-3-1-9(16)2-4-10/h1-5,7H,6H2,(H,21,22)
InChIKeyIURBBDFWBKEBII-UHFFFAOYSA-N
MW332.68 g/mol
LogP4.07
Rot. Bonds3

About 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide

2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide (PubChem CID 3299281) has the molecular formula C14H9ClF4N2O and a molecular weight of 332.68 g/mol. Its IUPAC name is 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide
PubChem CID3299281
Molecular FormulaC14H9ClF4N2O
Molecular Weight332.68 g/mol
Exact Mass332.03
IUPAC Name2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ncc(C(F)(F)F)cc1Cl)Nc1ccc(F)cc1
InChIInChI=1S/C14H9ClF4N2O/c15-11-5-8(14(17,18)19)7-20-12(11)6-13(22)21-10-3-1-9(16)2-4-10/h1-5,7H,6H2,(H,21,22)
InChIKeyIURBBDFWBKEBII-UHFFFAOYSA-N
XLogP4.07
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.68
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Fluopyram
CID 11158353
Fluopicolide
CID 11159021
Ica-27243
CID 9903497
Benzamide, 2-chloro-N-4-pyridinyl-
CID 5121684
N-(3-chloro-4-fluorophenyl)pyridine-3-carboxamide
CID 771964
Ztz240
CID 3780776
N-(4-chlorophenyl)-2-[4-[2-(trifluoromethyl)-4-pyridinyl]cyclohexyl]propanamide
CID 138490227
(+)-2-chloro-N-(3-(1-(trifluoromethyl)cyclopropyl)-2-(2-(trifluoromethyl)pyridin-5-yl)propyl)benzamide
CID 73673308
N-(2-Chloro-5-trifluoromethyl-phenyl)-nicotinamide
CID 668891
6-chloro-N-(4-methylphenyl)pyridine-3-carboxamide
CID 2664862
2-(2,6-dichlorophenyl)-N-(4-pyridyl)acetamide
CID 17173956
2-(2,4-dichlorophenyl)-N-(4-pyridyl)acetamide
CID 17838235

Frequently Asked Questions

What is the IUPAC name of 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide (CID 3299281) is 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide is O=C(Cc1ncc(C(F)(F)F)cc1Cl)Nc1ccc(F)cc1.
What is the InChIKey of 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide?
The InChIKey is IURBBDFWBKEBII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClF4N2O/c15-11-5-8(14(17,18)19)7-20-12(11)6-13(22)21-10-3-1-9(16)2-4-10/h1-5,7H,6H2,(H,21,22).
What are the key properties of 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide?
2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide has a molecular weight of 332.68 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 3299281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).