3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide

C19H24N4O — CID 1423418

IUPAC3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide
SMILESCCCn1nc(NC(=O)CC(C)C)c2cc3cccc(C)c3nc21
InChIInChI=1S/C19H24N4O/c1-5-9-23-19-15(18(22-23)20-16(24)10-12(2)3)11-14-8-6-7-13(4)17(14)21-19/h6-8,11-12H,5,9-10H2,1-4H3,(H,20,22,24)
InChIKeyZRHLHQJRYWWUCV-UHFFFAOYSA-N
MW324.43 g/mol
LogP4.29
Rot. Bonds5

About 3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide

3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide (PubChem CID 1423418) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is 3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide.

Molecular Properties

Compound Name3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide
PubChem CID1423418
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide
SMILESCCCn1nc(NC(=O)CC(C)C)c2cc3cccc(C)c3nc21
InChIInChI=1S/C19H24N4O/c1-5-9-23-19-15(18(22-23)20-16(24)10-12(2)3)11-14-8-6-7-13(4)17(14)21-19/h6-8,11-12H,5,9-10H2,1-4H3,(H,20,22,24)
InChIKeyZRHLHQJRYWWUCV-UHFFFAOYSA-N
XLogP4.29
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide 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-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide?
The IUPAC name of 3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide (CID 1423418) is 3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide.
What is the SMILES notation for 3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide?
The canonical SMILES for 3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide is CCCn1nc(NC(=O)CC(C)C)c2cc3cccc(C)c3nc21.
What is the InChIKey of 3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide?
The InChIKey is ZRHLHQJRYWWUCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-5-9-23-19-15(18(22-23)20-16(24)10-12(2)3)11-14-8-6-7-13(4)17(14)21-19/h6-8,11-12H,5,9-10H2,1-4H3,(H,20,22,24).
What are the key properties of 3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide?
3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide has a molecular weight of 324.43 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(8-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)butanamide is sourced from PubChem (CID 1423418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).