2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine

C8H13N3 — CID 82417238

IUPAC2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine
SMILESCc1c2c(nn1C)CNCC2
InChIInChI=1S/C8H13N3/c1-6-7-3-4-9-5-8(7)10-11(6)2/h9H,3-5H2,1-2H3
InChIKeyXQLGXRKJUDWXEK-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.37
Rot. Bonds

About 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine

2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine (PubChem CID 82417238) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine
PubChem CID82417238
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine
SMILESCc1c2c(nn1C)CNCC2
InChIInChI=1S/C8H13N3/c1-6-7-3-4-9-5-8(7)10-11(6)2/h9H,3-5H2,1-2H3
InChIKeyXQLGXRKJUDWXEK-UHFFFAOYSA-N
XLogP0.37
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine?
The IUPAC name of 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine (CID 82417238) is 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine.
What is the SMILES notation for 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine?
The canonical SMILES for 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine is Cc1c2c(nn1C)CNCC2.
What is the InChIKey of 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine?
The InChIKey is XQLGXRKJUDWXEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-6-7-3-4-9-5-8(7)10-11(6)2/h9H,3-5H2,1-2H3.
What are the key properties of 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine?
2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine has a molecular weight of 151.21 g/mol, XLogP of 0.37, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridine is sourced from PubChem (CID 82417238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).