N-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide

C20H15F3N2O2 — CID 88748536

IUPACN-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide
SMILESCc1c(F)c(F)cc(Oc2ncccc2C(=O)N(C)c2ccccc2)c1F
InChIInChI=1S/C20H15F3N2O2/c1-12-17(22)15(21)11-16(18(12)23)27-19-14(9-6-10-24-19)20(26)25(2)13-7-4-3-5-8-13/h3-11H,1-2H3
InChIKeyWVLCLXGZAORMQG-UHFFFAOYSA-N
MW372.35 g/mol
LogP4.88
Rot. Bonds4

About N-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide

N-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide (PubChem CID 88748536) has the molecular formula C20H15F3N2O2 and a molecular weight of 372.35 g/mol. Its IUPAC name is N-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide
PubChem CID88748536
Molecular FormulaC20H15F3N2O2
Molecular Weight372.35 g/mol
Exact Mass372.11
IUPAC NameN-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide
SMILESCc1c(F)c(F)cc(Oc2ncccc2C(=O)N(C)c2ccccc2)c1F
InChIInChI=1S/C20H15F3N2O2/c1-12-17(22)15(21)11-16(18(12)23)27-19-14(9-6-10-24-19)20(26)25(2)13-7-4-3-5-8-13/h3-11H,1-2H3
InChIKeyWVLCLXGZAORMQG-UHFFFAOYSA-N
XLogP4.88
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.35
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Analyze N-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-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-(4-fluorophenyl)-N-methyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide
CID 88747853
2-(3-chlorophenoxy)-N-(4-fluorophenyl)-N-methylpyridine-3-carboxamide
CID 12849372
N-(4-fluorophenyl)-N-methyl-2-[3-(trifluoromethyl)phenoxy]pyridine-3-carboxamide
CID 12849353
N-(4-hydroxyphenyl)-2-methoxy-N-methylpyridine-3-carboxamide
CID 60744120
N,2,3-trimethyl-N-phenylpyridine-4-carboxamide
CID 110856944
2-(2,5-dichlorophenoxy)-N-methyl-N-(2-phenylphenyl)pyridine-3-carboxamide
CID 59294533
2-(2,5-dichlorophenoxy)-N-ethyl-N-phenylpyridine-3-carboxamide
CID 46194702
2-fluoro-N-(3-fluorophenyl)-N-methylpyridine-3-carboxamide
CID 114037685
ethyl 2-(5-bromo-2,3-difluorophenoxy)pyridine-3-carboxylate
CID 107099524
N,2-dimethyl-N-phenylbenzamide
CID 5222383
2-chloro-N,3-dimethyl-N-phenylpyridine-4-carboxamide
CID 15075716
N-methyl-N-phenyl-2-pyrrolidin-1-ylpyridine-3-carboxamide
CID 36676473

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide?
The IUPAC name of N-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide (CID 88748536) is N-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide?
The canonical SMILES for N-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide is Cc1c(F)c(F)cc(Oc2ncccc2C(=O)N(C)c2ccccc2)c1F.
What is the InChIKey of N-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide?
The InChIKey is WVLCLXGZAORMQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F3N2O2/c1-12-17(22)15(21)11-16(18(12)23)27-19-14(9-6-10-24-19)20(26)25(2)13-7-4-3-5-8-13/h3-11H,1-2H3.
What are the key properties of N-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide?
N-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide has a molecular weight of 372.35 g/mol, XLogP of 4.88, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-phenyl-2-(2,4,5-trifluoro-3-methylphenoxy)pyridine-3-carboxamide is sourced from PubChem (CID 88748536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).