2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride

C6H7ClN4 — CID 155662054

IUPAC2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride
SMILESCl.Nc1[nH]nc2ncccc12
InChIInChI=1S/C6H6N4.ClH/c7-5-4-2-1-3-8-6(4)10-9-5;/h1-3H,(H3,7,8,9,10);1H
InChIKeyGGAUSSUHMWHVFO-UHFFFAOYSA-N
MW170.60 g/mol
LogP0.96
Rot. Bonds

About 2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride

2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride (PubChem CID 155662054) has the molecular formula C6H7ClN4 and a molecular weight of 170.60 g/mol. Its IUPAC name is 2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride.

Molecular Properties

Compound Name2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride
PubChem CID155662054
Molecular FormulaC6H7ClN4
Molecular Weight170.60 g/mol
Exact Mass170.04
IUPAC Name2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride
SMILESCl.Nc1[nH]nc2ncccc12
InChIInChI=1S/C6H6N4.ClH/c7-5-4-2-1-3-8-6(4)10-9-5;/h1-3H,(H3,7,8,9,10);1H
InChIKeyGGAUSSUHMWHVFO-UHFFFAOYSA-N
XLogP0.96
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.60
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;3-methyl-2H-pyrazolo[3,4-b]pyridine;propane
CID 143179270
3-tert-butyl-2H-pyrazolo[3,4-b]pyridine;ethane
CID 161040738
3-(2H-pyrazolo[3,4-b]pyridin-3-yl)prop-2-en-1-amine
CID 169463700
3-(2-chlorophenyl)-2H-pyrazolo[3,4-b]pyridine
CID 91667303
4-naphthalen-1-yl-2H-pyrazolo[3,4-b]pyridin-3-amine
CID 141330351
1-(2H-pyrazolo[3,4-b]pyridin-3-yl)propan-1-one
CID 134369259
3-(3-fluorophenyl)-2H-pyrazolo[3,4-b]pyridine
CID 174914335
4-(2H-pyrazolo[3,4-b]pyridin-3-yl)but-3-enal
CID 170482014
4-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine
CID 45078985
3-piperidin-3-yl-2H-pyrazolo[3,4-b]pyridine;tetrahydrochloride
CID 171687240
methyl 2,3-dihydroxy-3-(2H-pyrazolo[3,4-b]pyridin-3-yl)propanoate
CID 171864239
3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine
CID 141182116

Frequently Asked Questions

What is the IUPAC name of 2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride?
The IUPAC name of 2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride (CID 155662054) is 2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride.
What is the SMILES notation for 2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride?
The canonical SMILES for 2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride is Cl.Nc1[nH]nc2ncccc12.
What is the InChIKey of 2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride?
The InChIKey is GGAUSSUHMWHVFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4.ClH/c7-5-4-2-1-3-8-6(4)10-9-5;/h1-3H,(H3,7,8,9,10);1H.
What are the key properties of 2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride?
2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride has a molecular weight of 170.60 g/mol, XLogP of 0.96, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-pyrazolo[3,4-b]pyridin-3-amine;hydrochloride is sourced from PubChem (CID 155662054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).