7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine

C24H26F2N8 — CID 90288967

IUPAC7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
SMILESCC(C)c1cnnc(Nc2ccc3ncc(-c4cnn(CCCN5CC(F)(F)C5)c4)cc3n2)c1
InChIInChI=1S/C24H26F2N8/c1-16(2)17-9-23(32-28-11-17)31-22-5-4-20-21(30-22)8-18(10-27-20)19-12-29-34(13-19)7-3-6-33-14-24(25,26)15-33/h4-5,8-13,16H,3,6-7,14-15H2,1-2H3,(H,30,31,32)
InChIKeyXTEMJEBYDPUARS-UHFFFAOYSA-N
MW464.52 g/mol
LogP4.49
Rot. Bonds8

About 7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine

7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine (PubChem CID 90288967) has the molecular formula C24H26F2N8 and a molecular weight of 464.52 g/mol. Its IUPAC name is 7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine.

Molecular Properties

Compound Name7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
PubChem CID90288967
Molecular FormulaC24H26F2N8
Molecular Weight464.52 g/mol
Exact Mass464.22
IUPAC Name7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
SMILESCC(C)c1cnnc(Nc2ccc3ncc(-c4cnn(CCCN5CC(F)(F)C5)c4)cc3n2)c1
InChIInChI=1S/C24H26F2N8/c1-16(2)17-9-23(32-28-11-17)31-22-5-4-20-21(30-22)8-18(10-27-20)19-12-29-34(13-19)7-3-6-33-14-24(25,26)15-33/h4-5,8-13,16H,3,6-7,14-15H2,1-2H3,(H,30,31,32)
InChIKeyXTEMJEBYDPUARS-UHFFFAOYSA-N
XLogP4.49
TPSA84.65 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.52
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine 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 7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?
The IUPAC name of 7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine (CID 90288967) is 7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine.
What is the SMILES notation for 7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?
The canonical SMILES for 7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine is CC(C)c1cnnc(Nc2ccc3ncc(-c4cnn(CCCN5CC(F)(F)C5)c4)cc3n2)c1.
What is the InChIKey of 7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?
The InChIKey is XTEMJEBYDPUARS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26F2N8/c1-16(2)17-9-23(32-28-11-17)31-22-5-4-20-21(30-22)8-18(10-27-20)19-12-29-34(13-19)7-3-6-33-14-24(25,26)15-33/h4-5,8-13,16H,3,6-7,14-15H2,1-2H3,(H,30,31,32).
What are the key properties of 7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?
7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine has a molecular weight of 464.52 g/mol, XLogP of 4.49, 8 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[1-[3-(3,3-difluoroazetidin-1-yl)propyl]pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine is sourced from PubChem (CID 90288967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).