3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine

C12H13N5 — CID 103119741

IUPAC3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine
SMILESCCCc1nc(-c2cnn3ccccc23)n[nH]1
InChIInChI=1S/C12H13N5/c1-2-5-11-14-12(16-15-11)9-8-13-17-7-4-3-6-10(9)17/h3-4,6-8H,2,5H2,1H3,(H,14,15,16)
InChIKeyKCQZRMZBMAXSFV-UHFFFAOYSA-N
MW227.27 g/mol
LogP2.07
Rot. Bonds3

About 3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine

3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine (PubChem CID 103119741) has the molecular formula C12H13N5 and a molecular weight of 227.27 g/mol. Its IUPAC name is 3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine
PubChem CID103119741
Molecular FormulaC12H13N5
Molecular Weight227.27 g/mol
Exact Mass227.12
IUPAC Name3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine
SMILESCCCc1nc(-c2cnn3ccccc23)n[nH]1
InChIInChI=1S/C12H13N5/c1-2-5-11-14-12(16-15-11)9-8-13-17-7-4-3-6-10(9)17/h3-4,6-8H,2,5H2,1H3,(H,14,15,16)
InChIKeyKCQZRMZBMAXSFV-UHFFFAOYSA-N
XLogP2.07
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine?
The IUPAC name of 3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine (CID 103119741) is 3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine?
The canonical SMILES for 3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine is CCCc1nc(-c2cnn3ccccc23)n[nH]1.
What is the InChIKey of 3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine?
The InChIKey is KCQZRMZBMAXSFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N5/c1-2-5-11-14-12(16-15-11)9-8-13-17-7-4-3-6-10(9)17/h3-4,6-8H,2,5H2,1H3,(H,14,15,16).
What are the key properties of 3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine?
3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine has a molecular weight of 227.27 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-propyl-1H-1,2,4-triazol-3-yl)pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 103119741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).