4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide

C8H6FN5O2 — CID 107595088

IUPAC4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide
SMILESNc1nonc1C(=O)Nc1ccncc1F
InChIInChI=1S/C8H6FN5O2/c9-4-3-11-2-1-5(4)12-8(15)6-7(10)14-16-13-6/h1-3H,(H2,10,14)(H,11,12,15)
InChIKeyYLJLKFHICNRFOU-UHFFFAOYSA-N
MW223.17 g/mol
LogP0.44
Rot. Bonds2

About 4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide

4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide (PubChem CID 107595088) has the molecular formula C8H6FN5O2 and a molecular weight of 223.17 g/mol. Its IUPAC name is 4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide
PubChem CID107595088
Molecular FormulaC8H6FN5O2
Molecular Weight223.17 g/mol
Exact Mass223.05
IUPAC Name4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide
SMILESNc1nonc1C(=O)Nc1ccncc1F
InChIInChI=1S/C8H6FN5O2/c9-4-3-11-2-1-5(4)12-8(15)6-7(10)14-16-13-6/h1-3H,(H2,10,14)(H,11,12,15)
InChIKeyYLJLKFHICNRFOU-UHFFFAOYSA-N
XLogP0.44
TPSA106.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.17
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-amino-N-(3-fluoro-4-pyridinyl)pyridine-2-carboxamide
CID 107594913
2-amino-N-(3-fluoro-4-pyridinyl)benzamide
CID 107594598
4-amino-N-(5-fluoro-2-pyridinyl)-1,2,5-oxadiazole-3-carboxamide
CID 65482055
4-amino-N-(2-fluoro-5-methylsulfonylphenyl)-1,2,5-oxadiazole-3-carboxamide
CID 62688137
N-(3-fluoro-4-pyridinyl)-3-hydrazinylpyridine-4-carboxamide
CID 107595570
N-(3-fluoro-4-pyridinyl)-4-(methylamino)pyridine-3-carboxamide
CID 107595502
4-amino-N-(2-carbamoylphenyl)-1,2,5-oxadiazole-3-carboxamide
CID 62688483
4-amino-N-(2,4,5-trichlorophenyl)-1,2,5-oxadiazole-3-carboxamide
CID 55103950
5-amino-2-(dimethylamino)-N-(3-fluoro-4-pyridinyl)benzamide
CID 107594537
5-amino-N-(3-fluoro-4-pyridinyl)-2-methylbenzamide
CID 107594566
4-amino-N-[4-(difluoromethoxy)-3-fluorophenyl]-1,2,5-oxadiazole-3-carboxamide
CID 62688517
N-(3-fluoro-4-pyridinyl)-5-hydrazinylpyridine-2-carboxamide
CID 107595556

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide?
The IUPAC name of 4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide (CID 107595088) is 4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide?
The canonical SMILES for 4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide is Nc1nonc1C(=O)Nc1ccncc1F.
What is the InChIKey of 4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide?
The InChIKey is YLJLKFHICNRFOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FN5O2/c9-4-3-11-2-1-5(4)12-8(15)6-7(10)14-16-13-6/h1-3H,(H2,10,14)(H,11,12,15).
What are the key properties of 4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide?
4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide has a molecular weight of 223.17 g/mol, XLogP of 0.44, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(3-fluoro-4-pyridinyl)-1,2,5-oxadiazole-3-carboxamide is sourced from PubChem (CID 107595088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).