7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol

C6H8N4O — CID 135737559

IUPAC7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
SMILESCC1(O)C=CNc2ncnn21
InChIInChI=1S/C6H8N4O/c1-6(11)2-3-7-5-8-4-9-10(5)6/h2-4,11H,1H3,(H,7,8,9)
InChIKeyZAQFAWJJGMYVFA-UHFFFAOYSA-N
MW152.16 g/mol
LogP-0.12
Rot. Bonds

About 7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol

7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol (PubChem CID 135737559) has the molecular formula C6H8N4O and a molecular weight of 152.16 g/mol. Its IUPAC name is 7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol.

Molecular Properties

Compound Name7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
PubChem CID135737559
Molecular FormulaC6H8N4O
Molecular Weight152.16 g/mol
Exact Mass152.07
IUPAC Name7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
SMILESCC1(O)C=CNc2ncnn21
InChIInChI=1S/C6H8N4O/c1-6(11)2-3-7-5-8-4-9-10(5)6/h2-4,11H,1H3,(H,7,8,9)
InChIKeyZAQFAWJJGMYVFA-UHFFFAOYSA-N
XLogP-0.12
TPSA62.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.16
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-Methyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
CID 136196381
7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol;silver
CID 136438496
5-Methyl-4,5-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
CID 142898208
silver 7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
CID 135737558
7-Methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
CID 136694505

Frequently Asked Questions

What is the IUPAC name of 7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol?
The IUPAC name of 7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol (CID 135737559) is 7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol.
What is the SMILES notation for 7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol?
The canonical SMILES for 7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol is CC1(O)C=CNc2ncnn21.
What is the InChIKey of 7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol?
The InChIKey is ZAQFAWJJGMYVFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4O/c1-6(11)2-3-7-5-8-4-9-10(5)6/h2-4,11H,1H3,(H,7,8,9).
What are the key properties of 7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol?
7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol has a molecular weight of 152.16 g/mol, XLogP of -0.12, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-4H-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol is sourced from PubChem (CID 135737559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).