5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine

C10H7BrN4O — CID 70039457

IUPAC5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine
SMILESNc1[nH]nc2nc(-c3ccco3)c(Br)cc12
InChIInChI=1S/C10H7BrN4O/c11-6-4-5-9(12)14-15-10(5)13-8(6)7-2-1-3-16-7/h1-4H,(H3,12,13,14,15)
InChIKeyXNZISCRTJPZGFX-UHFFFAOYSA-N
MW279.10 g/mol
LogP2.56
Rot. Bonds1

About 5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine

5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine (PubChem CID 70039457) has the molecular formula C10H7BrN4O and a molecular weight of 279.10 g/mol. Its IUPAC name is 5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine.

Molecular Properties

Compound Name5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine
PubChem CID70039457
Molecular FormulaC10H7BrN4O
Molecular Weight279.10 g/mol
Exact Mass277.98
IUPAC Name5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine
SMILESNc1[nH]nc2nc(-c3ccco3)c(Br)cc12
InChIInChI=1S/C10H7BrN4O/c11-6-4-5-9(12)14-15-10(5)13-8(6)7-2-1-3-16-7/h1-4H,(H3,12,13,14,15)
InChIKeyXNZISCRTJPZGFX-UHFFFAOYSA-N
XLogP2.56
TPSA80.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.10
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(furan-2-yl)-6-methyl-2H-pyrazolo[3,4-b]pyridin-3-amine
CID 10632410
5-bromo-4,6-bis(furan-2-yl)pyrimidin-2-amine
CID 23020456
4-bromo-6-(furan-2-yl)pyridazin-3-amine
CID 117106412
6-(3,5-dimethoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine
CID 141462278
2-chloro-6-(furan-2-yl)pyrimidin-4-amine
CID 66520852
6-bromo-2-(furan-2-yl)-7-methylimidazo[1,2-a]pyridin-3-amine
CID 79729151
3-amino-6-(4-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile
CID 51348534
5-amino-3-(furan-2-yl)-1H-pyridazin-6-one
CID 51589117
3-(furan-2-yl)quinoxalin-2-amine
CID 102364345
7-chloro-2H-pyrazolo[3,4-b]quinolin-3-amine
CID 22334609
(3R)-1-benzyl-N-[5-bromo-6-(furan-2-yl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrrolidine-3-carboxamide
CID 101338283
2,4-dibromo-6-(furan-2-yl)aniline
CID 11267081

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine?
The IUPAC name of 5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine (CID 70039457) is 5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine.
What is the SMILES notation for 5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine?
The canonical SMILES for 5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine is Nc1[nH]nc2nc(-c3ccco3)c(Br)cc12.
What is the InChIKey of 5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine?
The InChIKey is XNZISCRTJPZGFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrN4O/c11-6-4-5-9(12)14-15-10(5)13-8(6)7-2-1-3-16-7/h1-4H,(H3,12,13,14,15).
What are the key properties of 5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine?
5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine has a molecular weight of 279.10 g/mol, XLogP of 2.56, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-(furan-2-yl)-2H-pyrazolo[3,4-b]pyridin-3-amine is sourced from PubChem (CID 70039457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).