4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine

C19H12FN5O — CID 134197820

IUPAC4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine
SMILESFc1cnc(-c2ccco2)c2ccc(Nc3n[nH]c4cccnc34)cc12
InChIInChI=1S/C19H12FN5O/c20-14-10-22-17(16-4-2-8-26-16)12-6-5-11(9-13(12)14)23-19-18-15(24-25-19)3-1-7-21-18/h1-10H,(H2,23,24,25)
InChIKeyGUUVJWHMHOCQKT-UHFFFAOYSA-N
MW345.34 g/mol
LogP4.65
Rot. Bonds3

About 4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine

4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine (PubChem CID 134197820) has the molecular formula C19H12FN5O and a molecular weight of 345.34 g/mol. Its IUPAC name is 4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine.

Molecular Properties

Compound Name4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine
PubChem CID134197820
Molecular FormulaC19H12FN5O
Molecular Weight345.34 g/mol
Exact Mass345.10
IUPAC Name4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine
SMILESFc1cnc(-c2ccco2)c2ccc(Nc3n[nH]c4cccnc34)cc12
InChIInChI=1S/C19H12FN5O/c20-14-10-22-17(16-4-2-8-26-16)12-6-5-11(9-13(12)14)23-19-18-15(24-25-19)3-1-7-21-18/h1-10H,(H2,23,24,25)
InChIKeyGUUVJWHMHOCQKT-UHFFFAOYSA-N
XLogP4.65
TPSA79.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.34
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(2S)-2-amino-3-phenylpropoxy]-5-[3-(furan-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridine
CID 23647441
2-Furan-2-yl-6-quinolin-8-yl-[1,2,4]triazolo[1,5-a]pyrazin-8-ylamine
CID 11381852
6-(furan-2-yl)-5-(pyrimidin-4-yl)-1H-pyrazolo[3,4-b]pyridine
CID 11952560
6-(2-Furyl)-5-pyrimidin-4-yl-1H-pyrazolo[3,4-b]pyridin-3-amine
CID 11952670
3-((S)-2-amino-3-phenylpropoxy)-5-(3-methyl-1H-pyrazolo[4,3-b]pyrazin-5-yl)-6-(2-methylfuran-3-yl)pyridin-2-amine
CID 25221040
CID 71461890
CID 71461890
(S)-3-(2-amino-3-phenylpropoxy)-N-ethyl-6-(furan-3-yl)-5-(3-methyl-1H-pyrazolo[4,3-b]pyrazin-5-yl)pyridin-2-amine
CID 46226135
5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]pyridin-3-yl]-3-[4-(furan-3-yl)-1H-indol-2-yl]-2H-pyrazolo[3,4-b]pyridine
CID 137040405
N-(6-fluoro-1H-pyrazolo[4,3-b]pyridin-3-yl)-1-[(3S)-oxolan-3-yl]oxyisoquinolin-6-amine
CID 148698316
N-(6-fluoro-1H-pyrazolo[4,3-b]pyridin-3-yl)-1-(2-methoxyethoxy)isoquinolin-6-amine
CID 156227704
2-(furan-2-yl)-6-(1H-indazol-5-yl)-N-pyridin-3-ylquinoline-4-carboxamide
CID 60202474
US10227343, Example 24
CID 134191491

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine?
The IUPAC name of 4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine (CID 134197820) is 4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine.
What is the SMILES notation for 4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine?
The canonical SMILES for 4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine is Fc1cnc(-c2ccco2)c2ccc(Nc3n[nH]c4cccnc34)cc12.
What is the InChIKey of 4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine?
The InChIKey is GUUVJWHMHOCQKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12FN5O/c20-14-10-22-17(16-4-2-8-26-16)12-6-5-11(9-13(12)14)23-19-18-15(24-25-19)3-1-7-21-18/h1-10H,(H2,23,24,25).
What are the key properties of 4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine?
4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine has a molecular weight of 345.34 g/mol, XLogP of 4.65, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-(furan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine is sourced from PubChem (CID 134197820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).