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

C10H9N7O2 — CID 8891832

IUPAC7-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1nnc(NC(=O)c2nc3nccc(C)n3n2)o1
InChIInChI=1S/C10H9N7O2/c1-5-3-4-11-9-12-7(16-17(5)9)8(18)13-10-15-14-6(2)19-10/h3-4H,1-2H3,(H,13,15,18)
InChIKeyYYJFUVPBHIXJEJ-UHFFFAOYSA-N
MW259.23 g/mol
LogP0.38
Rot. Bonds2

About 7-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

7-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 8891832) has the molecular formula C10H9N7O2 and a molecular weight of 259.23 g/mol. Its IUPAC name is 7-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound Name7-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID8891832
Molecular FormulaC10H9N7O2
Molecular Weight259.23 g/mol
Exact Mass259.08
IUPAC Name7-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCc1nnc(NC(=O)c2nc3nccc(C)n3n2)o1
InChIInChI=1S/C10H9N7O2/c1-5-3-4-11-9-12-7(16-17(5)9)8(18)13-10-15-14-6(2)19-10/h3-4H,1-2H3,(H,13,15,18)
InChIKeyYYJFUVPBHIXJEJ-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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Related Compounds

N-(5-ethyl-1,3,4-thiadiazol-2-yl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 2397006
7-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 2505294
N-(5-butyl-1,3,4-thiadiazol-2-yl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 2564268
N-(cyclopropylmethyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 34831861
N-{7-Methyl-[1,2,4]triazolo[1,5-A]pyrimidin-2-YL}acetamide
CID 23607348
N-(1,3-dimethyl-1H-pyrazol-5-yl)-2-{4-[4-(methylamino)pyrimidin-2-yl]-1H-pyrazol-1-yl}acetamide
CID 46990046
(2S)-N-(7-methyl-[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)-2-pyrazol-1-ylbutanamide
CID 164638527
N-{1-[3-(trifluoromethyl)-1H-pyrazol-1-yl]propan-2-yl}[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 44824570
N~2~-{2-Methyl-3-[3-(trifluoromethyl)-1H-pyrazol-1-YL]propyl}[1,2,4]triazolo[1,5-A]pyrimidine-2-carboxamide
CID 44824614
N~2~-{3-[3-(Trifluoromethyl)-1H-pyrazol-1-YL]pentyl}[1,2,4]triazolo[1,5-A]pyrimidine-2-carboxamide
CID 44824695
N-(1,3-dimethyl-1H-pyrazol-5-yl)-2-{4-[4-(trifluoromethyl)pyrimidin-2-yl]-1H-pyrazol-1-yl}acetamide
CID 46987271
N-(2-methylpyrazol-3-yl)-2-[4-[4-(trifluoromethyl)pyrimidin-2-yl]pyrazol-1-yl]acetamide
CID 46994377

Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of 7-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide (CID 8891832) is 7-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 7-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for 7-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide is Cc1nnc(NC(=O)c2nc3nccc(C)n3n2)o1.
What is the InChIKey of 7-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is YYJFUVPBHIXJEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N7O2/c1-5-3-4-11-9-12-7(16-17(5)9)8(18)13-10-15-14-6(2)19-10/h3-4H,1-2H3,(H,13,15,18).
What are the key properties of 7-methyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
7-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 7-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 8891832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).