N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide

C20H18FN3O3 — CID 109245646

IUPACN-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cncc(Nc3cccc(F)c3)c2)c(OC)c1
InChIInChI=1S/C20H18FN3O3/c1-26-17-6-7-18(19(10-17)27-2)24-20(25)13-8-16(12-22-11-13)23-15-5-3-4-14(21)9-15/h3-12,23H,1-2H3,(H,24,25)
InChIKeyFKWCGHNJGJRZNO-UHFFFAOYSA-N
MW367.38 g/mol
LogP4.23
Rot. Bonds6

About N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide

N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide (PubChem CID 109245646) has the molecular formula C20H18FN3O3 and a molecular weight of 367.38 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide
PubChem CID109245646
Molecular FormulaC20H18FN3O3
Molecular Weight367.38 g/mol
Exact Mass367.13
IUPAC NameN-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cncc(Nc3cccc(F)c3)c2)c(OC)c1
InChIInChI=1S/C20H18FN3O3/c1-26-17-6-7-18(19(10-17)27-2)24-20(25)13-8-16(12-22-11-13)23-15-5-3-4-14(21)9-15/h3-12,23H,1-2H3,(H,24,25)
InChIKeyFKWCGHNJGJRZNO-UHFFFAOYSA-N
XLogP4.23
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.38
LogP ≤ 54.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
CID 109245660
5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 109245108
N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109245476
N-(2,4-dimethylphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide
CID 109242702
N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide
CID 109293921
N-(2,4-dimethoxyphenyl)-6-(3-fluoroanilino)pyridazine-3-carboxamide
CID 109129697
N-(3-fluorophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
CID 109245541
N-(2,4-difluorophenyl)-5-(3,4-dimethoxyanilino)pyridine-3-carboxamide
CID 109245690
5-(5-chloro-2-methoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
CID 109245070
5-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109245203
5-(2,5-dimethoxyanilino)-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 109244111
N-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide
CID 109244180

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide (CID 109245646) is N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide is COc1ccc(NC(=O)c2cncc(Nc3cccc(F)c3)c2)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide?
The InChIKey is FKWCGHNJGJRZNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O3/c1-26-17-6-7-18(19(10-17)27-2)24-20(25)13-8-16(12-22-11-13)23-15-5-3-4-14(21)9-15/h3-12,23H,1-2H3,(H,24,25).
What are the key properties of N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide?
N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide has a molecular weight of 367.38 g/mol, XLogP of 4.23, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109245646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).