N-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine

C11H10N6 — CID 138692755

IUPACN-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine
SMILESc1cnc(CNc2ccnc3cn[nH]c23)cn1
InChIInChI=1S/C11H10N6/c1-2-14-10-7-16-17-11(10)9(1)15-6-8-5-12-3-4-13-8/h1-5,7H,6H2,(H,14,15)(H,16,17)
InChIKeyKGKHUMYJAHKJNW-UHFFFAOYSA-N
MW226.24 g/mol
LogP1.36
Rot. Bonds3

About N-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine

N-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine (PubChem CID 138692755) has the molecular formula C11H10N6 and a molecular weight of 226.24 g/mol. Its IUPAC name is N-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine.

Molecular Properties

Compound NameN-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine
PubChem CID138692755
Molecular FormulaC11H10N6
Molecular Weight226.24 g/mol
Exact Mass226.10
IUPAC NameN-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine
SMILESc1cnc(CNc2ccnc3cn[nH]c23)cn1
InChIInChI=1S/C11H10N6/c1-2-14-10-7-16-17-11(10)9(1)15-6-8-5-12-3-4-13-8/h1-5,7H,6H2,(H,14,15)(H,16,17)
InChIKeyKGKHUMYJAHKJNW-UHFFFAOYSA-N
XLogP1.36
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine?
The IUPAC name of N-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine (CID 138692755) is N-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine.
What is the SMILES notation for N-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine?
The canonical SMILES for N-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine is c1cnc(CNc2ccnc3cn[nH]c23)cn1.
What is the InChIKey of N-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine?
The InChIKey is KGKHUMYJAHKJNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N6/c1-2-14-10-7-16-17-11(10)9(1)15-6-8-5-12-3-4-13-8/h1-5,7H,6H2,(H,14,15)(H,16,17).
What are the key properties of N-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine?
N-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine has a molecular weight of 226.24 g/mol, XLogP of 1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyrazin-2-ylmethyl)-1H-pyrazolo[4,3-b]pyridin-7-amine is sourced from PubChem (CID 138692755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).