2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide

C20H17F2N3O3 — CID 109178357

IUPAC2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide
SMILESCOc1ccc(NC(=O)c2ccnc(Nc3ccc(F)cc3F)c2)c(OC)c1
InChIInChI=1S/C20H17F2N3O3/c1-27-14-4-6-17(18(11-14)28-2)25-20(26)12-7-8-23-19(9-12)24-16-5-3-13(21)10-15(16)22/h3-11H,1-2H3,(H,23,24)(H,25,26)
InChIKeyYCPVHPSYRWOJIV-UHFFFAOYSA-N
MW385.37 g/mol
LogP4.37
Rot. Bonds6

About 2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide

2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide (PubChem CID 109178357) has the molecular formula C20H17F2N3O3 and a molecular weight of 385.37 g/mol. Its IUPAC name is 2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide
PubChem CID109178357
Molecular FormulaC20H17F2N3O3
Molecular Weight385.37 g/mol
Exact Mass385.12
IUPAC Name2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide
SMILESCOc1ccc(NC(=O)c2ccnc(Nc3ccc(F)cc3F)c2)c(OC)c1
InChIInChI=1S/C20H17F2N3O3/c1-27-14-4-6-17(18(11-14)28-2)25-20(26)12-7-8-23-19(9-12)24-16-5-3-13(21)10-15(16)22/h3-11H,1-2H3,(H,23,24)(H,25,26)
InChIKeyYCPVHPSYRWOJIV-UHFFFAOYSA-N
XLogP4.37
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.37
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,4-difluorophenyl)-2-(3,4-dimethoxyanilino)pyridine-4-carboxamide
CID 109178399
N-(2,4-dimethoxyphenyl)-2-(2,5-dimethylanilino)pyridine-4-carboxamide
CID 109176642
6-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridazine-3-carboxamide
CID 109129699
N-(2,5-dimethoxyphenyl)-2-(4-fluoroanilino)pyridine-4-carboxamide
CID 109177330
2-(3-chloro-4-methoxyanilino)-N-(2,4-difluorophenyl)pyridine-4-carboxamide
CID 109177809
5-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-2-carboxamide
CID 109200219
2-(2,4-dimethoxyanilino)-N-(3,4-dimethylphenyl)pyridine-4-carboxamide
CID 109176664
N-(2,4-dimethoxyphenyl)-2-methoxypyridine-4-carboxamide
CID 84580517
2-(2,4-difluoroanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide
CID 109176722
N-(2,4-dimethoxyphenyl)-4-fluorobenzamide
CID 2832276
2-(2,4-dimethoxyanilino)-N-[(2-fluorophenyl)methyl]pyridine-4-carboxamide
CID 109170430
N'-(2,4-difluorophenyl)-N-(2,4-dimethoxyphenyl)oxamide
CID 44998467

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide (CID 109178357) is 2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide is COc1ccc(NC(=O)c2ccnc(Nc3ccc(F)cc3F)c2)c(OC)c1.
What is the InChIKey of 2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide?
The InChIKey is YCPVHPSYRWOJIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F2N3O3/c1-27-14-4-6-17(18(11-14)28-2)25-20(26)12-7-8-23-19(9-12)24-16-5-3-13(21)10-15(16)22/h3-11H,1-2H3,(H,23,24)(H,25,26).
What are the key properties of 2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide?
2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide has a molecular weight of 385.37 g/mol, XLogP of 4.37, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 109178357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).