2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine

C8H13N3 — CID 146338854

IUPAC2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine
SMILESCCn1cc2c(n1)NCCC2
InChIInChI=1S/C8H13N3/c1-2-11-6-7-4-3-5-9-8(7)10-11/h6H,2-5H2,1H3,(H,9,10)
InChIKeySVFFZHOLJINRGP-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.26
Rot. Bonds1

About 2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine

2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine (PubChem CID 146338854) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine
PubChem CID146338854
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine
SMILESCCn1cc2c(n1)NCCC2
InChIInChI=1S/C8H13N3/c1-2-11-6-7-4-3-5-9-8(7)10-11/h6H,2-5H2,1H3,(H,9,10)
InChIKeySVFFZHOLJINRGP-UHFFFAOYSA-N
XLogP1.26
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine?
The IUPAC name of 2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine (CID 146338854) is 2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine.
What is the SMILES notation for 2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine?
The canonical SMILES for 2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine is CCn1cc2c(n1)NCCC2.
What is the InChIKey of 2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine?
The InChIKey is SVFFZHOLJINRGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-2-11-6-7-4-3-5-9-8(7)10-11/h6H,2-5H2,1H3,(H,9,10).
What are the key properties of 2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine?
2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine has a molecular weight of 151.21 g/mol, XLogP of 1.26, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-b]pyridine is sourced from PubChem (CID 146338854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).