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

C20H18FN3O3 — CID 109244180

IUPACN-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2cncc(Nc3ccccc3F)c2)c1
InChIInChI=1S/C20H18FN3O3/c1-26-15-7-8-19(27-2)18(10-15)24-20(25)13-9-14(12-22-11-13)23-17-6-4-3-5-16(17)21/h3-12,23H,1-2H3,(H,24,25)
InChIKeyUAKCOXFYCJTRPT-UHFFFAOYSA-N
MW367.38 g/mol
LogP4.23
Rot. Bonds6

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

N-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide (PubChem CID 109244180) has the molecular formula C20H18FN3O3 and a molecular weight of 367.38 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide
PubChem CID109244180
Molecular FormulaC20H18FN3O3
Molecular Weight367.38 g/mol
Exact Mass367.13
IUPAC NameN-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2cncc(Nc3ccccc3F)c2)c1
InChIInChI=1S/C20H18FN3O3/c1-26-15-7-8-19(27-2)18(10-15)24-20(25)13-9-14(12-22-11-13)23-17-6-4-3-5-16(17)21/h3-12,23H,1-2H3,(H,24,25)
InChIKeyUAKCOXFYCJTRPT-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-(2,5-dimethoxyanilino)-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 109244111
5-(2-fluoroanilino)-N-(4-methoxyphenyl)pyridine-3-carboxamide
CID 109244174
N-(2-chlorophenyl)-5-(2,5-dimethoxyanilino)pyridine-3-carboxamide
CID 109244383
5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 109245108
5-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109245203
5-(2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)pyridine-3-carboxamide
CID 109243138
N-(2,5-dimethoxyphenyl)-5-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109228308
N-(2,5-dimethoxyphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
CID 109234341
N-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide
CID 109243335
5-(2,5-dimethoxyanilino)-N-propan-2-ylpyridine-3-carboxamide
CID 109223294
N-(2,5-dimethoxyphenyl)-5-(pentylamino)pyridine-3-carboxamide
CID 109240183
N-(2,5-dimethoxyphenyl)-5-(3-methylbutylamino)pyridine-3-carboxamide
CID 109239954

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide (CID 109244180) is N-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide is COc1ccc(OC)c(NC(=O)c2cncc(Nc3ccccc3F)c2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide?
The InChIKey is UAKCOXFYCJTRPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O3/c1-26-15-7-8-19(27-2)18(10-15)24-20(25)13-9-14(12-22-11-13)23-17-6-4-3-5-16(17)21/h3-12,23H,1-2H3,(H,24,25).
What are the key properties of N-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide?
N-(2,5-dimethoxyphenyl)-5-(2-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-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109244180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).