N-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride

C16H12Cl2N4 — CID 22417787

IUPACN-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride
SMILESCl.Clc1ccc(Nc2ccnc3ccc4cn[nH]c4c23)cc1
InChIInChI=1S/C16H11ClN4.ClH/c17-11-2-4-12(5-3-11)20-14-7-8-18-13-6-1-10-9-19-21-16(10)15(13)14;/h1-9H,(H,18,20)(H,19,21);1H
InChIKeyXGPUTECYVSVYFM-UHFFFAOYSA-N
MW331.21 g/mol
LogP4.93
Rot. Bonds2

About N-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride

N-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride (PubChem CID 22417787) has the molecular formula C16H12Cl2N4 and a molecular weight of 331.21 g/mol. Its IUPAC name is N-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride.

Molecular Properties

Compound NameN-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride
PubChem CID22417787
Molecular FormulaC16H12Cl2N4
Molecular Weight331.21 g/mol
Exact Mass330.04
IUPAC NameN-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride
SMILESCl.Clc1ccc(Nc2ccnc3ccc4cn[nH]c4c23)cc1
InChIInChI=1S/C16H11ClN4.ClH/c17-11-2-4-12(5-3-11)20-14-7-8-18-13-6-1-10-9-19-21-16(10)15(13)14;/h1-9H,(H,18,20)(H,19,21);1H
InChIKeyXGPUTECYVSVYFM-UHFFFAOYSA-N
XLogP4.93
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.21
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride?
The IUPAC name of N-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride (CID 22417787) is N-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride.
What is the SMILES notation for N-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride?
The canonical SMILES for N-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride is Cl.Clc1ccc(Nc2ccnc3ccc4cn[nH]c4c23)cc1.
What is the InChIKey of N-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride?
The InChIKey is XGPUTECYVSVYFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClN4.ClH/c17-11-2-4-12(5-3-11)20-14-7-8-18-13-6-1-10-9-19-21-16(10)15(13)14;/h1-9H,(H,18,20)(H,19,21);1H.
What are the key properties of N-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride?
N-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride has a molecular weight of 331.21 g/mol, XLogP of 4.93, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine;hydrochloride is sourced from PubChem (CID 22417787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).