4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide

C23H16FN3O2 — CID 10172758

IUPAC4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide
SMILESO=C(Nc1cc(Oc2cccnc2)cc(-c2ccccn2)c1)c1ccc(F)cc1
InChIInChI=1S/C23H16FN3O2/c24-18-8-6-16(7-9-18)23(28)27-19-12-17(22-5-1-2-11-26-22)13-21(14-19)29-20-4-3-10-25-15-20/h1-15H,(H,27,28)
InChIKeyJIWOQJSUFBYTQZ-UHFFFAOYSA-N
MW385.40 g/mol
LogP5.33
Rot. Bonds5

About 4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide

4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide (PubChem CID 10172758) has the molecular formula C23H16FN3O2 and a molecular weight of 385.40 g/mol. Its IUPAC name is 4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide.

Molecular Properties

Compound Name4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide
PubChem CID10172758
Molecular FormulaC23H16FN3O2
Molecular Weight385.40 g/mol
Exact Mass385.12
IUPAC Name4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide
SMILESO=C(Nc1cc(Oc2cccnc2)cc(-c2ccccn2)c1)c1ccc(F)cc1
InChIInChI=1S/C23H16FN3O2/c24-18-8-6-16(7-9-18)23(28)27-19-12-17(22-5-1-2-11-26-22)13-21(14-19)29-20-4-3-10-25-15-20/h1-15H,(H,27,28)
InChIKeyJIWOQJSUFBYTQZ-UHFFFAOYSA-N
XLogP5.33
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.40
LogP ≤ 55.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-fluoro-N-[3-[1-(2-methoxyethoxymethyl)tetrazol-5-yl]-5-pyridin-3-yloxyphenyl]benzamide
CID 22136189
2-(3-pyridin-3-yloxyphenyl)pyridine
CID 123250920
4-fluoro-N-(4-nitro-3-pyridin-3-yloxyphenyl)benzamide
CID 69092508
4-fluoro-N-(2-pyridin-3-ylpyrimidin-5-yl)benzamide
CID 137419125
N-(4-fluorophenyl)pyridine-3-carboxamide;hydrochloride
CID 110756411
N-(3,5-dimethylphenyl)-4-pyridin-2-ylbenzamide
CID 143032339
3-chloro-N-[3-pyridin-3-yloxy-5-(trifluoromethyl)phenyl]benzamide
CID 58337701
N-naphthalen-2-yl-4-pyridin-2-ylbenzamide
CID 59673032
3-chloro-N-(3-pyridin-3-yloxyphenyl)benzamide
CID 58337765
4-(2-hydroxypropan-2-yl)-N-(3-pyridin-2-ylphenyl)benzamide
CID 142392143
4-fluoro-N-(6-pyrazin-2-yl-3-pyridinyl)benzamide
CID 169324519
N-[3-amino-5-(4-fluorophenoxy)phenyl]pyridine-4-carboxamide
CID 5213441

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide?
The IUPAC name of 4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide (CID 10172758) is 4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide.
What is the SMILES notation for 4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide?
The canonical SMILES for 4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide is O=C(Nc1cc(Oc2cccnc2)cc(-c2ccccn2)c1)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide?
The InChIKey is JIWOQJSUFBYTQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16FN3O2/c24-18-8-6-16(7-9-18)23(28)27-19-12-17(22-5-1-2-11-26-22)13-21(14-19)29-20-4-3-10-25-15-20/h1-15H,(H,27,28).
What are the key properties of 4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide?
4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide has a molecular weight of 385.40 g/mol, XLogP of 5.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(3-pyridin-2-yl-5-pyridin-3-yloxyphenyl)benzamide is sourced from PubChem (CID 10172758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).