6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine

C13H16N4O — CID 71813811

IUPAC6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine
SMILESNc1cccc(COc2cc3n(n2)CCCC3)n1
InChIInChI=1S/C13H16N4O/c14-12-6-3-4-10(15-12)9-18-13-8-11-5-1-2-7-17(11)16-13/h3-4,6,8H,1-2,5,7,9H2,(H2,14,15)
InChIKeySDWBVMYHTQZVAG-UHFFFAOYSA-N
MW244.30 g/mol
LogP1.78
Rot. Bonds3

About 6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine

6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine (PubChem CID 71813811) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine
PubChem CID71813811
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine
SMILESNc1cccc(COc2cc3n(n2)CCCC3)n1
InChIInChI=1S/C13H16N4O/c14-12-6-3-4-10(15-12)9-18-13-8-11-5-1-2-7-17(11)16-13/h3-4,6,8H,1-2,5,7,9H2,(H2,14,15)
InChIKeySDWBVMYHTQZVAG-UHFFFAOYSA-N
XLogP1.78
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine?
The IUPAC name of 6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine (CID 71813811) is 6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine.
What is the SMILES notation for 6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine?
The canonical SMILES for 6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine is Nc1cccc(COc2cc3n(n2)CCCC3)n1.
What is the InChIKey of 6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine?
The InChIKey is SDWBVMYHTQZVAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c14-12-6-3-4-10(15-12)9-18-13-8-11-5-1-2-7-17(11)16-13/h3-4,6,8H,1-2,5,7,9H2,(H2,14,15).
What are the key properties of 6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine?
6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine has a molecular weight of 244.30 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 6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yloxymethyl)pyridin-2-amine is sourced from PubChem (CID 71813811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).