6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine

C10H14N4 — CID 159341106

IUPAC6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESCCC(C)(C)c1cnc2ncnn2c1
InChIInChI=1S/C10H14N4/c1-4-10(2,3)8-5-11-9-12-7-13-14(9)6-8/h5-7H,4H2,1-3H3
InChIKeyFIUUIWVMFKRPOM-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.81
Rot. Bonds2

About 6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine

6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine (PubChem CID 159341106) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine
PubChem CID159341106
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESCCC(C)(C)c1cnc2ncnn2c1
InChIInChI=1S/C10H14N4/c1-4-10(2,3)8-5-11-9-12-7-13-14(9)6-8/h5-7H,4H2,1-3H3
InChIKeyFIUUIWVMFKRPOM-UHFFFAOYSA-N
XLogP1.81
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-2-amine
CID 84767353
2-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-1-amine
CID 84767352
5-(2-methylbutan-2-yl)pyrimidin-2-amine
CID 123717080
3-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propan-1-ol
CID 15578993
6-(2-methylbutan-2-yl)pyrrolo[1,2-b]pyridazine
CID 169144840
1-methyl-5-(2-methylbutan-2-yl)-1,2,4-triazole
CID 143445836
2-amino-1-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone
CID 84767265
1-(2-methoxyethyl)-4-(2-methylbutan-2-yl)pyrazole
CID 145022478
1-(cyclopropylmethyl)-4-(2-methylbutan-2-yl)pyrazole
CID 155261599
3-([1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoic acid
CID 84772253
6-(2-phenylethynyl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 50913149
2-butan-2-yl-5-(2-methylbutan-2-yl)pyridine
CID 90395896

Frequently Asked Questions

What is the IUPAC name of 6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine?
The IUPAC name of 6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine (CID 159341106) is 6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine.
What is the SMILES notation for 6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine?
The canonical SMILES for 6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine is CCC(C)(C)c1cnc2ncnn2c1.
What is the InChIKey of 6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine?
The InChIKey is FIUUIWVMFKRPOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-4-10(2,3)8-5-11-9-12-7-13-14(9)6-8/h5-7H,4H2,1-3H3.
What are the key properties of 6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine?
6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine has a molecular weight of 190.25 g/mol, XLogP of 1.81, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methylbutan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine is sourced from PubChem (CID 159341106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).