5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide

C20H18FN3O3 — CID 109245660

IUPAC5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
SMILESCOc1ccc(Nc2cncc(C(=O)Nc3cccc(F)c3)c2)c(OC)c1
InChIInChI=1S/C20H18FN3O3/c1-26-17-6-7-18(19(10-17)27-2)23-16-8-13(11-22-12-16)20(25)24-15-5-3-4-14(21)9-15/h3-12,23H,1-2H3,(H,24,25)
InChIKeyQMHMZUAZSGYIDB-UHFFFAOYSA-N
MW367.38 g/mol
LogP4.23
Rot. Bonds6

About 5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide

5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide (PubChem CID 109245660) has the molecular formula C20H18FN3O3 and a molecular weight of 367.38 g/mol. Its IUPAC name is 5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
PubChem CID109245660
Molecular FormulaC20H18FN3O3
Molecular Weight367.38 g/mol
Exact Mass367.13
IUPAC Name5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
SMILESCOc1ccc(Nc2cncc(C(=O)Nc3cccc(F)c3)c2)c(OC)c1
InChIInChI=1S/C20H18FN3O3/c1-26-17-6-7-18(19(10-17)27-2)23-16-8-13(11-22-12-16)20(25)24-15-5-3-4-14(21)9-15/h3-12,23H,1-2H3,(H,24,25)
InChIKeyQMHMZUAZSGYIDB-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

N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide
CID 109245646
N-(3-fluorophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
CID 109245541
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-(5-chloro-2-methoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
CID 109245070
5-(2,4-dimethoxyanilino)-N-(4-ethylphenyl)pyridine-3-carboxamide
CID 109243459
N-(1,3-benzodioxol-5-yl)-5-(2,4-dimethoxyanilino)pyridine-3-carboxamide
CID 109245661
5-(2,4-dimethoxyanilino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109243833
5-(2,4-dimethoxyanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 109236471
N-(3-fluorophenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109236961
5-(2,4-dimethylanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109242737
methyl 4-chloro-3-[[5-[(3-fluorophenyl)carbamoyl]-3-pyridinyl]amino]benzoate
CID 109245987

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide?
The IUPAC name of 5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide (CID 109245660) is 5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide is COc1ccc(Nc2cncc(C(=O)Nc3cccc(F)c3)c2)c(OC)c1.
What is the InChIKey of 5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide?
The InChIKey is QMHMZUAZSGYIDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O3/c1-26-17-6-7-18(19(10-17)27-2)23-16-8-13(11-22-12-16)20(25)24-15-5-3-4-14(21)9-15/h3-12,23H,1-2H3,(H,24,25).
What are the key properties of 5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide?
5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)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 5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109245660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).