3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one

C16H11ClN4O — CID 135599993

IUPAC3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one
SMILESNc1c2c(=O)[nH]c3ccccc3c2nn1-c1ccc(Cl)cc1
InChIInChI=1S/C16H11ClN4O/c17-9-5-7-10(8-6-9)21-15(18)13-14(20-21)11-3-1-2-4-12(11)19-16(13)22/h1-8H,18H2,(H,19,22)
InChIKeyCUDZEASSAFBPCK-UHFFFAOYSA-N
MW310.74 g/mol
LogP3.10
Rot. Bonds1

About 3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one

3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one (PubChem CID 135599993) has the molecular formula C16H11ClN4O and a molecular weight of 310.74 g/mol. Its IUPAC name is 3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one.

Molecular Properties

Compound Name3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one
PubChem CID135599993
Molecular FormulaC16H11ClN4O
Molecular Weight310.74 g/mol
Exact Mass310.06
IUPAC Name3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one
SMILESNc1c2c(=O)[nH]c3ccccc3c2nn1-c1ccc(Cl)cc1
InChIInChI=1S/C16H11ClN4O/c17-9-5-7-10(8-6-9)21-15(18)13-14(20-21)11-3-1-2-4-12(11)19-16(13)22/h1-8H,18H2,(H,19,22)
InChIKeyCUDZEASSAFBPCK-UHFFFAOYSA-N
XLogP3.10
TPSA76.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.74
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one 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 3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one?
The IUPAC name of 3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one (CID 135599993) is 3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one.
What is the SMILES notation for 3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one?
The canonical SMILES for 3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one is Nc1c2c(=O)[nH]c3ccccc3c2nn1-c1ccc(Cl)cc1.
What is the InChIKey of 3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one?
The InChIKey is CUDZEASSAFBPCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClN4O/c17-9-5-7-10(8-6-9)21-15(18)13-14(20-21)11-3-1-2-4-12(11)19-16(13)22/h1-8H,18H2,(H,19,22).
What are the key properties of 3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one?
3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one has a molecular weight of 310.74 g/mol, XLogP of 3.10, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-(4-chlorophenyl)-5H-pyrazolo[4,3-c]quinolin-4-one is sourced from PubChem (CID 135599993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).