[2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine

C15H23N5 — CID 117129335

IUPAC[2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine
SMILESCC(C)N1CCCC(c2nc3ccc(CN)cn3n2)C1
InChIInChI=1S/C15H23N5/c1-11(2)19-7-3-4-13(10-19)15-17-14-6-5-12(8-16)9-20(14)18-15/h5-6,9,11,13H,3-4,7-8,10,16H2,1-2H3
InChIKeyVXYGULTYSQSKPT-UHFFFAOYSA-N
MW273.38 g/mol
LogP1.78
Rot. Bonds3

About [2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine

[2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine (PubChem CID 117129335) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is [2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine.

Molecular Properties

Compound Name[2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine
PubChem CID117129335
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC Name[2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine
SMILESCC(C)N1CCCC(c2nc3ccc(CN)cn3n2)C1
InChIInChI=1S/C15H23N5/c1-11(2)19-7-3-4-13(10-19)15-17-14-6-5-12(8-16)9-20(14)18-15/h5-6,9,11,13H,3-4,7-8,10,16H2,1-2H3
InChIKeyVXYGULTYSQSKPT-UHFFFAOYSA-N
XLogP1.78
TPSA59.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine?
The IUPAC name of [2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine (CID 117129335) is [2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine.
What is the SMILES notation for [2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine?
The canonical SMILES for [2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine is CC(C)N1CCCC(c2nc3ccc(CN)cn3n2)C1.
What is the InChIKey of [2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine?
The InChIKey is VXYGULTYSQSKPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-11(2)19-7-3-4-13(10-19)15-17-14-6-5-12(8-16)9-20(14)18-15/h5-6,9,11,13H,3-4,7-8,10,16H2,1-2H3.
What are the key properties of [2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine?
[2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine has a molecular weight of 273.38 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-propan-2-ylpiperidin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methanamine is sourced from PubChem (CID 117129335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).