N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide

C11H9FN4O2 — CID 114037619

IUPACN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide
SMILESO=C(Nc1nnc(C2CC2)o1)c1cccnc1F
InChIInChI=1S/C11H9FN4O2/c12-8-7(2-1-5-13-8)9(17)14-11-16-15-10(18-11)6-3-4-6/h1-2,5-6H,3-4H2,(H,14,16,17)
InChIKeyYOOZIZZSZSYHER-UHFFFAOYSA-N
MW248.22 g/mol
LogP1.73
Rot. Bonds3

About N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide

N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide (PubChem CID 114037619) has the molecular formula C11H9FN4O2 and a molecular weight of 248.22 g/mol. Its IUPAC name is N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide
PubChem CID114037619
Molecular FormulaC11H9FN4O2
Molecular Weight248.22 g/mol
Exact Mass248.07
IUPAC NameN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide
SMILESO=C(Nc1nnc(C2CC2)o1)c1cccnc1F
InChIInChI=1S/C11H9FN4O2/c12-8-7(2-1-5-13-8)9(17)14-11-16-15-10(18-11)6-3-4-6/h1-2,5-6H,3-4H2,(H,14,16,17)
InChIKeyYOOZIZZSZSYHER-UHFFFAOYSA-N
XLogP1.73
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.22
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(2-ethyl-2H-tetrazol-5-yl)nicotinamide
CID 666994
2-fluoro-N-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)benzamide
CID 3463675
2-cyano-N-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)acetamide
CID 155562273
4-fluoro-N-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)benzamide
CID 5080054
N-(2H-tetrazol-5-yl)pyridine-3-carboxamide
CID 4069765
[1-(5-Cyclopropyl-1,3,4-oxadiazol-2-yl)piperidin-3-yl](pyridin-3-yl)methanone
CID 72881765
3-fluoro-N-(5-(pyridin-4-yl)-1,3,4-oxadiazol-2-yl)benzamide
CID 4454091
N-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarboxamide
CID 7158403
N-(2-propyl-2H-tetrazol-5-yl)nicotinamide
CID 959826
N-[5-(Pyridin-4-YL)-1,3,4-oxadiazol-2-YL]cyclopropanecarboxamide
CID 3463667
3-fluoro-N-(5-(pyridin-3-yl)-1,3,4-oxadiazol-2-yl)benzamide
CID 4299645
2-fluoro-N-(5-(pyridin-3-yl)-1,3,4-oxadiazol-2-yl)benzamide
CID 4616785

Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide?
The IUPAC name of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide (CID 114037619) is N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide.
What is the SMILES notation for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide?
The canonical SMILES for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide is O=C(Nc1nnc(C2CC2)o1)c1cccnc1F.
What is the InChIKey of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide?
The InChIKey is YOOZIZZSZSYHER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN4O2/c12-8-7(2-1-5-13-8)9(17)14-11-16-15-10(18-11)6-3-4-6/h1-2,5-6H,3-4H2,(H,14,16,17).
What are the key properties of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide?
N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide has a molecular weight of 248.22 g/mol, XLogP of 1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-fluoropyridine-3-carboxamide is sourced from PubChem (CID 114037619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).