5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine

C8H6F2N4O — CID 150590039

IUPAC5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine
SMILESNc1ccc(-c2nnc(C(F)F)o2)cn1
InChIInChI=1S/C8H6F2N4O/c9-6(10)8-14-13-7(15-8)4-1-2-5(11)12-3-4/h1-3,6H,(H2,11,12)
InChIKeyIPRDMAFZXOEPPJ-UHFFFAOYSA-N
MW212.16 g/mol
LogP1.65
Rot. Bonds2

About 5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine

5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine (PubChem CID 150590039) has the molecular formula C8H6F2N4O and a molecular weight of 212.16 g/mol. Its IUPAC name is 5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine.

Molecular Properties

Compound Name5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine
PubChem CID150590039
Molecular FormulaC8H6F2N4O
Molecular Weight212.16 g/mol
Exact Mass212.05
IUPAC Name5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine
SMILESNc1ccc(-c2nnc(C(F)F)o2)cn1
InChIInChI=1S/C8H6F2N4O/c9-6(10)8-14-13-7(15-8)4-1-2-5(11)12-3-4/h1-3,6H,(H2,11,12)
InChIKeyIPRDMAFZXOEPPJ-UHFFFAOYSA-N
XLogP1.65
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.16
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine?
The IUPAC name of 5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine (CID 150590039) is 5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine.
What is the SMILES notation for 5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine?
The canonical SMILES for 5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine is Nc1ccc(-c2nnc(C(F)F)o2)cn1.
What is the InChIKey of 5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine?
The InChIKey is IPRDMAFZXOEPPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F2N4O/c9-6(10)8-14-13-7(15-8)4-1-2-5(11)12-3-4/h1-3,6H,(H2,11,12).
What are the key properties of 5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine?
5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine has a molecular weight of 212.16 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]pyridin-2-amine is sourced from PubChem (CID 150590039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).