8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine

C10H17N5 — CID 54255630

IUPAC8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine
SMILESc1nc2n(n1)CCNC2CN1CCCC1
InChIInChI=1S/C10H17N5/c1-2-5-14(4-1)7-9-10-12-8-13-15(10)6-3-11-9/h8-9,11H,1-7H2
InChIKeyQZVYBPNQZVGZKD-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.02
Rot. Bonds2

About 8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine

8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine (PubChem CID 54255630) has the molecular formula C10H17N5 and a molecular weight of 207.28 g/mol. Its IUPAC name is 8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine
PubChem CID54255630
Molecular FormulaC10H17N5
Molecular Weight207.28 g/mol
Exact Mass207.15
IUPAC Name8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine
SMILESc1nc2n(n1)CCNC2CN1CCCC1
InChIInChI=1S/C10H17N5/c1-2-5-14(4-1)7-9-10-12-8-13-15(10)6-3-11-9/h8-9,11H,1-7H2
InChIKeyQZVYBPNQZVGZKD-UHFFFAOYSA-N
XLogP0.02
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine?
The IUPAC name of 8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine (CID 54255630) is 8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine.
What is the SMILES notation for 8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine?
The canonical SMILES for 8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine is c1nc2n(n1)CCNC2CN1CCCC1.
What is the InChIKey of 8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine?
The InChIKey is QZVYBPNQZVGZKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5/c1-2-5-14(4-1)7-9-10-12-8-13-15(10)6-3-11-9/h8-9,11H,1-7H2.
What are the key properties of 8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine?
8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine has a molecular weight of 207.28 g/mol, XLogP of 0.02, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine is sourced from PubChem (CID 54255630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).