4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide

C18H14FN3O2 — CID 122539711

IUPAC4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide
SMILESNC(=O)c1cc(-c2ccc(F)cc2)c(OCc2ccncc2)cn1
InChIInChI=1S/C18H14FN3O2/c19-14-3-1-13(2-4-14)15-9-16(18(20)23)22-10-17(15)24-11-12-5-7-21-8-6-12/h1-10H,11H2,(H2,20,23)
InChIKeyBEQBVWBWKHGSEO-UHFFFAOYSA-N
MW323.33 g/mol
LogP2.96
Rot. Bonds5

About 4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide

4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide (PubChem CID 122539711) has the molecular formula C18H14FN3O2 and a molecular weight of 323.33 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide
PubChem CID122539711
Molecular FormulaC18H14FN3O2
Molecular Weight323.33 g/mol
Exact Mass323.11
IUPAC Name4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide
SMILESNC(=O)c1cc(-c2ccc(F)cc2)c(OCc2ccncc2)cn1
InChIInChI=1S/C18H14FN3O2/c19-14-3-1-13(2-4-14)15-9-16(18(20)23)22-10-17(15)24-11-12-5-7-21-8-6-12/h1-10H,11H2,(H2,20,23)
InChIKeyBEQBVWBWKHGSEO-UHFFFAOYSA-N
XLogP2.96
TPSA78.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.33
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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
4-tert-butyl-N-(6-pyridin-3-yloxypyridin-3-yl)benzamide
CID 2800172
N-(6-pyridin-3-yloxypyridin-3-yl)-4-(trifluoromethyl)benzamide
CID 2800173
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
[3-(2-Tert-butyl-4-fluorophenoxy)azetidin-1-yl]-pyridin-2-ylmethanone
CID 59577179
4-[4-(4-Fluoro-phenyl)-2-(1-methyl-piperidin-4-yl)-oxazol-5-yl]-pyridine
CID 44399530
[5-(4-Fluoro-phenyl)-furan-2-ylmethyl]-pyridin-2-ylmethyl-amine
CID 6464045
6-[4-(4-Fluorophenoxy)phenyl]-4-morpholin-4-ylpyridine-2-carboxamide
CID 10340527
N-(4-tert-butylphenyl)-4-(3-propoxypyridin-2-yl)benzamide
CID 44416971
N-[(5,6-dimethoxy-2-pyridinyl)methyl]-5-(2-fluorophenyl)-2-(5-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 46191662

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide?
The IUPAC name of 4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide (CID 122539711) is 4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide.
What is the SMILES notation for 4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide?
The canonical SMILES for 4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide is NC(=O)c1cc(-c2ccc(F)cc2)c(OCc2ccncc2)cn1.
What is the InChIKey of 4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide?
The InChIKey is BEQBVWBWKHGSEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FN3O2/c19-14-3-1-13(2-4-14)15-9-16(18(20)23)22-10-17(15)24-11-12-5-7-21-8-6-12/h1-10H,11H2,(H2,20,23).
What are the key properties of 4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide?
4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide has a molecular weight of 323.33 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-5-(pyridin-4-ylmethoxy)pyridine-2-carboxamide is sourced from PubChem (CID 122539711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).