4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide

C20H18FN3O3 — CID 122539601

IUPAC4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide
SMILESCOc1ccc(-c2cc(C(N)=O)ncc2OCc2ccc(C)nc2)c(F)c1
InChIInChI=1S/C20H18FN3O3/c1-12-3-4-13(9-23-12)11-27-19-10-24-18(20(22)25)8-16(19)15-6-5-14(26-2)7-17(15)21/h3-10H,11H2,1-2H3,(H2,22,25)
InChIKeyIZIBSGQPFIKWGL-UHFFFAOYSA-N
MW367.38 g/mol
LogP3.28
Rot. Bonds6

About 4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide

4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide (PubChem CID 122539601) has the molecular formula C20H18FN3O3 and a molecular weight of 367.38 g/mol. Its IUPAC name is 4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide
PubChem CID122539601
Molecular FormulaC20H18FN3O3
Molecular Weight367.38 g/mol
Exact Mass367.13
IUPAC Name4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide
SMILESCOc1ccc(-c2cc(C(N)=O)ncc2OCc2ccc(C)nc2)c(F)c1
InChIInChI=1S/C20H18FN3O3/c1-12-3-4-13(9-23-12)11-27-19-10-24-18(20(22)25)8-16(19)15-6-5-14(26-2)7-17(15)21/h3-10H,11H2,1-2H3,(H2,22,25)
InChIKeyIZIBSGQPFIKWGL-UHFFFAOYSA-N
XLogP3.28
TPSA87.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.38
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(3-methylpyrazin-2-yl)phenyl]-N-[(1R)-1-[5-(2,2,2-trifluoroethoxy)pyridin-2-yl]ethyl]acetamide
CID 42609962
5-(4-((Phenethylamino)methyl)phenoxy)picolinamide
CID 44434951
N-[(5,6-dimethoxy-2-pyridinyl)methyl]-5-(3-fluorophenyl)-2-(5-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 45375925
2-[4-(4-methyl-1,3-oxazol-5-yl)phenyl]-N-[(1R)-1-[5-(2,2,2-trifluoroethoxy)pyridin-2-yl]ethyl]acetamide
CID 57948490
5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxy]-N-methylpyridine-2-carboxamide
CID 68504950
5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxy]-N-ethylpyridine-2-carboxamide
CID 68506820
4-tert-butyl-N-(6-pyridin-3-yloxypyridin-3-yl)benzamide
CID 2800172
5-Ethoxy-Pyridine-2-Carboxylic Acid [3-((R)-2-Amino-5,5-Difluoro-4-Methyl-5,6-Dihydro-4h-[1,3]oxazin-4-Yl)-4-Fluoro-Phenyl]-Amide
CID 71305034
4-[4-(4-Fluoro-phenyl)-2-(1-methyl-piperidin-4-yl)-oxazol-5-yl]-pyridine
CID 44399530
Pyridine-2-carboxylic acid [3-(4-isopropoxy-benzoylamino)-propyl]-amide
CID 2985370
[5-(4-Fluoro-phenyl)-furan-2-ylmethyl]-pyridin-2-ylmethyl-amine
CID 6464045
N-((5-(4-fluoro-2-methoxyphenyl)pyridin-3-yl)methyl)picolinamide
CID 54587759

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide?
The IUPAC name of 4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide (CID 122539601) is 4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide.
What is the SMILES notation for 4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide?
The canonical SMILES for 4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide is COc1ccc(-c2cc(C(N)=O)ncc2OCc2ccc(C)nc2)c(F)c1.
What is the InChIKey of 4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide?
The InChIKey is IZIBSGQPFIKWGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O3/c1-12-3-4-13(9-23-12)11-27-19-10-24-18(20(22)25)8-16(19)15-6-5-14(26-2)7-17(15)21/h3-10H,11H2,1-2H3,(H2,22,25).
What are the key properties of 4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide?
4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide has a molecular weight of 367.38 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoro-4-methoxyphenyl)-5-[(6-methyl-3-pyridinyl)methoxy]pyridine-2-carboxamide is sourced from PubChem (CID 122539601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).