5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

C10H9N7O2 — CID 4801640

IUPAC5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1ccn2nc(C(=O)Nc3nnc(C)o3)nc2n1
InChIInChI=1S/C10H9N7O2/c1-5-3-4-17-9(11-5)12-7(16-17)8(18)13-10-15-14-6(2)19-10/h3-4H,1-2H3,(H,13,15,18)
InChIKeyHXNJRSYFGPKLKH-UHFFFAOYSA-N
MW259.23 g/mol
LogP0.38
Rot. Bonds2

About 5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 4801640) has the molecular formula C10H9N7O2 and a molecular weight of 259.23 g/mol. Its IUPAC name is 5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID4801640
Molecular FormulaC10H9N7O2
Molecular Weight259.23 g/mol
Exact Mass259.08
IUPAC Name5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1ccn2nc(C(=O)Nc3nnc(C)o3)nc2n1
InChIInChI=1S/C10H9N7O2/c1-5-3-4-17-9(11-5)12-7(16-17)8(18)13-10-15-14-6(2)19-10/h3-4H,1-2H3,(H,13,15,18)
InChIKeyHXNJRSYFGPKLKH-UHFFFAOYSA-N
XLogP0.38
TPSA111.10 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.23
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of 5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide (CID 4801640) is 5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for 5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for 5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide is Cc1ccn2nc(C(=O)Nc3nnc(C)o3)nc2n1.
What is the InChIKey of 5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is HXNJRSYFGPKLKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N7O2/c1-5-3-4-17-9(11-5)12-7(16-17)8(18)13-10-15-14-6(2)19-10/h3-4H,1-2H3,(H,13,15,18).
What are the key properties of 5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 259.23 g/mol, XLogP of 0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 4801640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).