7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine

C8H8N4 — CID 1485500

IUPAC7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESc1cc(C2CC2)n2ncnc2n1
InChIInChI=1S/C8H8N4/c1-2-6(1)7-3-4-9-8-10-5-11-12(7)8/h3-6H,1-2H2
InChIKeyCVHDPQIBDHWAQK-UHFFFAOYSA-N
MW160.18 g/mol
LogP1.00
Rot. Bonds1

About 7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine

7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine (PubChem CID 1485500) has the molecular formula C8H8N4 and a molecular weight of 160.18 g/mol. Its IUPAC name is 7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine
PubChem CID1485500
Molecular FormulaC8H8N4
Molecular Weight160.18 g/mol
Exact Mass160.07
IUPAC Name7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESc1cc(C2CC2)n2ncnc2n1
InChIInChI=1S/C8H8N4/c1-2-6(1)7-3-4-9-8-10-5-11-12(7)8/h3-6H,1-2H2
InChIKeyCVHDPQIBDHWAQK-UHFFFAOYSA-N
XLogP1.00
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.18
LogP ≤ 51.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine?
The IUPAC name of 7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine (CID 1485500) is 7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine is c1cc(C2CC2)n2ncnc2n1.
What is the InChIKey of 7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine?
The InChIKey is CVHDPQIBDHWAQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4/c1-2-6(1)7-3-4-9-8-10-5-11-12(7)8/h3-6H,1-2H2.
What are the key properties of 7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine?
7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine has a molecular weight of 160.18 g/mol, XLogP of 1.00, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclopropyl-[1,2,4]triazolo[1,5-a]pyrimidine is sourced from PubChem (CID 1485500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).