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

C24H27N7O — CID 118510149

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

7-[1-(oxan-4-ylmethyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine (PubChem CID 118510149) has the molecular formula C24H27N7O and a molecular weight of 429.53 g/mol. Its IUPAC name is 7-[1-(oxan-4-ylmethyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine.

Molecular Properties

• Compound Name: 7-[1-(oxan-4-ylmethyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
• PubChem CID: 118510149
• Molecular Formula: C24H27N7O
• Molecular Weight: 429.53 g/mol
• Exact Mass: 429.23
• IUPAC Name: 7-[1-(oxan-4-ylmethyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
• SMILES: CC(C)c1cnnc(Nc2ccc3ncc(-c4cnn(CC5CCOCC5)c4)cc3n2)c1
• InChI: InChI=1S/C24H27N7O/c1-16(2)18-10-24(30-26-12-18)29-23-4-3-21-22(28-23)9-19(11-25-21)20-13-27-31(15-20)14-17-5-7-32-8-6-17/h3-4,9-13,15-17H,5-8,14H2,1-2H3,(H,28,29,30)
• InChIKey: RIPMMVBEIVRING-UHFFFAOYSA-N
• XLogP: 4.58
• TPSA: 90.64 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 6
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	429.53
LogP ≤ 5	4.58
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 7-[1-(oxan-4-ylmethyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?

The IUPAC name of 7-[1-(oxan-4-ylmethyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine (CID 118510149) is 7-[1-(oxan-4-ylmethyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine.

What is the SMILES notation for 7-[1-(oxan-4-ylmethyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?

The canonical SMILES for 7-[1-(oxan-4-ylmethyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine is CC(C)c1cnnc(Nc2ccc3ncc(-c4cnn(CC5CCOCC5)c4)cc3n2)c1.

What is the InChIKey of 7-[1-(oxan-4-ylmethyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?

The InChIKey is RIPMMVBEIVRING-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N7O/c1-16(2)18-10-24(30-26-12-18)29-23-4-3-21-22(28-23)9-19(11-25-21)20-13-27-31(15-20)14-17-5-7-32-8-6-17/h3-4,9-13,15-17H,5-8,14H2,1-2H3,(H,28,29,30).

What are the key properties of 7-[1-(oxan-4-ylmethyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?

7-[1-(oxan-4-ylmethyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine has a molecular weight of 429.53 g/mol, XLogP of 4.58, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 7-[1-(oxan-4-ylmethyl)pyrazol-4-yl]-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine is sourced from PubChem (CID 118510149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).