5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine

C8H7BrN4O — CID 67057573

IUPAC5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine
SMILESCc1nnc(-c2cc(Br)cnc2N)o1
InChIInChI=1S/C8H7BrN4O/c1-4-12-13-8(14-4)6-2-5(9)3-11-7(6)10/h2-3H,1H3,(H2,10,11)
InChIKeyHWYZSTKJNKXLIB-UHFFFAOYSA-N
MW255.07 g/mol
LogP1.78
Rot. Bonds1

About 5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine

5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine (PubChem CID 67057573) has the molecular formula C8H7BrN4O and a molecular weight of 255.07 g/mol. Its IUPAC name is 5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine
PubChem CID67057573
Molecular FormulaC8H7BrN4O
Molecular Weight255.07 g/mol
Exact Mass253.98
IUPAC Name5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine
SMILESCc1nnc(-c2cc(Br)cnc2N)o1
InChIInChI=1S/C8H7BrN4O/c1-4-12-13-8(14-4)6-2-5(9)3-11-7(6)10/h2-3H,1H3,(H2,10,11)
InChIKeyHWYZSTKJNKXLIB-UHFFFAOYSA-N
XLogP1.78
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.07
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine?
The IUPAC name of 5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine (CID 67057573) is 5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine?
The canonical SMILES for 5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine is Cc1nnc(-c2cc(Br)cnc2N)o1.
What is the InChIKey of 5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine?
The InChIKey is HWYZSTKJNKXLIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7BrN4O/c1-4-12-13-8(14-4)6-2-5(9)3-11-7(6)10/h2-3H,1H3,(H2,10,11).
What are the key properties of 5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine?
5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine has a molecular weight of 255.07 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-(5-methyl-1,3,4-oxadiazol-2-yl)pyridin-2-amine is sourced from PubChem (CID 67057573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).