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

C10H8N6O2 — CID 821892

IUPACN-(5-methyl-1,2-oxazol-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1cc(NC(=O)c2nc3ncccn3n2)no1
InChIInChI=1S/C10H8N6O2/c1-6-5-7(15-18-6)12-9(17)8-13-10-11-3-2-4-16(10)14-8/h2-5H,1H3,(H,12,15,17)
InChIKeyQQWZYIHYACFXRX-UHFFFAOYSA-N
MW244.21 g/mol
LogP0.67
Rot. Bonds2

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

N-(5-methyl-1,2-oxazol-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 821892) has the molecular formula C10H8N6O2 and a molecular weight of 244.21 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID821892
Molecular FormulaC10H8N6O2
Molecular Weight244.21 g/mol
Exact Mass244.07
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1cc(NC(=O)c2nc3ncccn3n2)no1
InChIInChI=1S/C10H8N6O2/c1-6-5-7(15-18-6)12-9(17)8-13-10-11-3-2-4-16(10)14-8/h2-5H,1H3,(H,12,15,17)
InChIKeyQQWZYIHYACFXRX-UHFFFAOYSA-N
XLogP0.67
TPSA98.21 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.21
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide (CID 821892) is N-(5-methyl-1,2-oxazol-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide is Cc1cc(NC(=O)c2nc3ncccn3n2)no1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is QQWZYIHYACFXRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N6O2/c1-6-5-7(15-18-6)12-9(17)8-13-10-11-3-2-4-16(10)14-8/h2-5H,1H3,(H,12,15,17).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
N-(5-methyl-1,2-oxazol-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 244.21 g/mol, XLogP of 0.67, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 821892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).