4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride

C8H15Cl2N3 — CID 122156683

IUPAC4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride
SMILESCl.Cl.NCc1cc2n(n1)CCCC2
InChIInChI=1S/C8H13N3.2ClH/c9-6-7-5-8-3-1-2-4-11(8)10-7;;/h5H,1-4,6,9H2;2*1H
InChIKeyMISJOJDOLXBTPJ-UHFFFAOYSA-N
MW224.13 g/mol
LogP1.52
Rot. Bonds1

About 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride

4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride (PubChem CID 122156683) has the molecular formula C8H15Cl2N3 and a molecular weight of 224.13 g/mol. Its IUPAC name is 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride.

Molecular Properties

Compound Name4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride
PubChem CID122156683
Molecular FormulaC8H15Cl2N3
Molecular Weight224.13 g/mol
Exact Mass223.06
IUPAC Name4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride
SMILESCl.Cl.NCc1cc2n(n1)CCCC2
InChIInChI=1S/C8H13N3.2ClH/c9-6-7-5-8-3-1-2-4-11(8)10-7;;/h5H,1-4,6,9H2;2*1H
InChIKeyMISJOJDOLXBTPJ-UHFFFAOYSA-N
XLogP1.52
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.13
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride?
The IUPAC name of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride (CID 122156683) is 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride.
What is the SMILES notation for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride?
The canonical SMILES for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride is Cl.Cl.NCc1cc2n(n1)CCCC2.
What is the InChIKey of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride?
The InChIKey is MISJOJDOLXBTPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3.2ClH/c9-6-7-5-8-3-1-2-4-11(8)10-7;;/h5H,1-4,6,9H2;2*1H.
What are the key properties of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride?
4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride has a molecular weight of 224.13 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine;dihydrochloride is sourced from PubChem (CID 122156683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).