5-pyridin-3-yl-1,3,4-oxadiazol-2-amine

C7H6N4O — CID 21940

IUPAC5-pyridin-3-yl-1,3,4-oxadiazol-2-amine
SMILESNc1nnc(-c2cccnc2)o1
InChIInChI=1S/C7H6N4O/c8-7-11-10-6(12-7)5-2-1-3-9-4-5/h1-4H,(H2,8,11)
InChIKeyJMAJFOJPCCULLE-UHFFFAOYSA-N
MW162.15 g/mol
LogP0.71
Rot. Bonds1

About 5-pyridin-3-yl-1,3,4-oxadiazol-2-amine

5-pyridin-3-yl-1,3,4-oxadiazol-2-amine (PubChem CID 21940) has the molecular formula C7H6N4O and a molecular weight of 162.15 g/mol. Its IUPAC name is 5-pyridin-3-yl-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-pyridin-3-yl-1,3,4-oxadiazol-2-amine
PubChem CID21940
Molecular FormulaC7H6N4O
Molecular Weight162.15 g/mol
Exact Mass162.05
IUPAC Name5-pyridin-3-yl-1,3,4-oxadiazol-2-amine
SMILESNc1nnc(-c2cccnc2)o1
InChIInChI=1S/C7H6N4O/c8-7-11-10-6(12-7)5-2-1-3-9-4-5/h1-4H,(H2,8,11)
InChIKeyJMAJFOJPCCULLE-UHFFFAOYSA-N
XLogP0.71
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.15
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1,3,4-Oxadiazole, 2-amino-5-(4-pyridyl)-
CID 12804
3-[5-(Prop-2-en-1-ylsulfanyl)-1,3,4-oxadiazol-2-yl]pyridine
CID 4920344
1,3,4-Oxadiazol-2-amine, N-phenyl-5-(3-pyridinyl)-
CID 3041662
2,5-Bis(3-pyridyl)-1,3,4-oxadiazole
CID 98903
3-methyl-N-(5-(pyridin-3-yl)-1,3,4-oxadiazol-2-yl)benzamide
CID 4645483
2-methyl-N-(5-(pyridin-3-yl)-1,3,4-oxadiazol-2-yl)benzamide
CID 5078768
ethyl (1E)-N-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methanimidate
CID 155547250
1-Phenyl-3-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)urea
CID 155547749
(E)-1-(4-chlorophenyl)-N-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methanimine
CID 155551683
2-cyano-N-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)acetamide
CID 155562273
N-[(E)-benzylideneamino]-5-pyridin-4-yl-1,3,4-oxadiazol-2-amine
CID 155562605
(E)-1-(4-nitrophenyl)-N-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)methanimine
CID 155563162

Frequently Asked Questions

What is the IUPAC name of 5-pyridin-3-yl-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-pyridin-3-yl-1,3,4-oxadiazol-2-amine (CID 21940) is 5-pyridin-3-yl-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-pyridin-3-yl-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-pyridin-3-yl-1,3,4-oxadiazol-2-amine is Nc1nnc(-c2cccnc2)o1.
What is the InChIKey of 5-pyridin-3-yl-1,3,4-oxadiazol-2-amine?
The InChIKey is JMAJFOJPCCULLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N4O/c8-7-11-10-6(12-7)5-2-1-3-9-4-5/h1-4H,(H2,8,11).
What are the key properties of 5-pyridin-3-yl-1,3,4-oxadiazol-2-amine?
5-pyridin-3-yl-1,3,4-oxadiazol-2-amine has a molecular weight of 162.15 g/mol, XLogP of 0.71, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-3-yl-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 21940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).