N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide

C18H18F3N3O — CID 109182289

IUPACN-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
SMILESO=C(NC1CCCC1)c1ccc(Nc2ccccc2C(F)(F)F)cn1
InChIInChI=1S/C18H18F3N3O/c19-18(20,21)14-7-3-4-8-15(14)23-13-9-10-16(22-11-13)17(25)24-12-5-1-2-6-12/h3-4,7-12,23H,1-2,5-6H2,(H,24,25)
InChIKeyOIRVKSVHKXVURP-UHFFFAOYSA-N
MW349.36 g/mol
LogP4.52
Rot. Bonds4

About N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide

N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide (PubChem CID 109182289) has the molecular formula C18H18F3N3O and a molecular weight of 349.36 g/mol. Its IUPAC name is N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
PubChem CID109182289
Molecular FormulaC18H18F3N3O
Molecular Weight349.36 g/mol
Exact Mass349.14
IUPAC NameN-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
SMILESO=C(NC1CCCC1)c1ccc(Nc2ccccc2C(F)(F)F)cn1
InChIInChI=1S/C18H18F3N3O/c19-18(20,21)14-7-3-4-8-15(14)23-13-9-10-16(22-11-13)17(25)24-12-5-1-2-6-12/h3-4,7-12,23H,1-2,5-6H2,(H,24,25)
InChIKeyOIRVKSVHKXVURP-UHFFFAOYSA-N
XLogP4.52
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.36
LogP ≤ 54.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide 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-cyclopentyl-5-(2-methylanilino)pyridine-2-carboxamide
CID 109182241
5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 67532141
N-[5-[2-(trifluoromethyl)anilino]-2-pyridinyl]cyclohexanecarboxamide
CID 113034806
N-(2,4-difluorophenyl)-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 109200283
N-cycloheptyl-5-(2,3,4-trifluoroanilino)pyridine-2-carboxamide
CID 109195345
N-cyclopropyl-2-[2-(trifluoromethyl)anilino]pyrimidine-5-carboxamide
CID 109247396
N-cyclopropyl-2-[2-(trifluoromethyl)anilino]pyrimidine-4-carboxamide
CID 109295853
N-cyclopropyl-5-(2,3-dimethylanilino)pyridine-2-carboxamide
CID 109179934
6-N-cyclopropyl-2-N-[2-(trifluoromethyl)phenyl]pyridine-2,6-dicarboxamide
CID 109093944
5-(2,6-difluoroanilino)-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 109200277
N-cyclopropyl-5-[6-[2-(trifluoromethyl)benzoyl]-3-pyridinyl]pyridine-2-carboxamide
CID 69397773
N-cycloheptyl-5-(4-methylanilino)pyridine-2-carboxamide
CID 109195297

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide?
The IUPAC name of N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide (CID 109182289) is N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide is O=C(NC1CCCC1)c1ccc(Nc2ccccc2C(F)(F)F)cn1.
What is the InChIKey of N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide?
The InChIKey is OIRVKSVHKXVURP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F3N3O/c19-18(20,21)14-7-3-4-8-15(14)23-13-9-10-16(22-11-13)17(25)24-12-5-1-2-6-12/h3-4,7-12,23H,1-2,5-6H2,(H,24,25).
What are the key properties of N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide?
N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide has a molecular weight of 349.36 g/mol, XLogP of 4.52, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide is sourced from PubChem (CID 109182289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).