5-(2,7-diazaspiro[3.5]nonan-2-yl)-2-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-2,7-naphthyridin-1-one

C31H39N7O — CID 168970918

About 5-(2,7-diazaspiro[3.5]nonan-2-yl)-2-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-2,7-naphthyridin-1-one

5-(2,7-diazaspiro[3.5]nonan-2-yl)-2-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-2,7-naphthyridin-1-one (PubChem CID 168970918) has the molecular formula C31H39N7O and a molecular weight of 525.70 g/mol. Its IUPAC name is 5-(2,7-diazaspiro[3.5]nonan-2-yl)-2-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-2,7-naphthyridin-1-one.

Molecular Properties

• Compound Name: 5-(2,7-diazaspiro[3.5]nonan-2-yl)-2-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-2,7-naphthyridin-1-one
• PubChem CID: 168970918
• Molecular Formula: C31H39N7O
• Molecular Weight: 525.70 g/mol
• Exact Mass: 525.32
• IUPAC Name: 5-(2,7-diazaspiro[3.5]nonan-2-yl)-2-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-2,7-naphthyridin-1-one
• SMILES: CC1(C)CCN(Cc2ccc3nc(Cn4ccc5c(N6CC7(CCNCC7)C6)cncc5c4=O)cn3c2)CC1
• InChI: InChI=1S/C31H39N7O/c1-30(2)8-13-35(14-9-30)17-23-3-4-28-34-24(20-37(28)18-23)19-36-12-5-25-26(29(36)39)15-33-16-27(25)38-21-31(22-38)6-10-32-11-7-31/h3-5,12,15-16,18,20,32H,6-11,13-14,17,19,21-22H2,1-2H3
• InChIKey: JOZGPXNKRQCLJP-UHFFFAOYSA-N
• XLogP: 3.90
• TPSA: 70.70 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 5
• Heavy Atoms: 39
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	525.70
LogP ≤ 5	3.90
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 5-(2,7-diazaspiro[3.5]nonan-2-yl)-2-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-2,7-naphthyridin-1-one?

The IUPAC name of 5-(2,7-diazaspiro[3.5]nonan-2-yl)-2-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-2,7-naphthyridin-1-one (CID 168970918) is 5-(2,7-diazaspiro[3.5]nonan-2-yl)-2-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-2,7-naphthyridin-1-one.

What is the SMILES notation for 5-(2,7-diazaspiro[3.5]nonan-2-yl)-2-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-2,7-naphthyridin-1-one?

The canonical SMILES for 5-(2,7-diazaspiro[3.5]nonan-2-yl)-2-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-2,7-naphthyridin-1-one is CC1(C)CCN(Cc2ccc3nc(Cn4ccc5c(N6CC7(CCNCC7)C6)cncc5c4=O)cn3c2)CC1.

What is the InChIKey of 5-(2,7-diazaspiro[3.5]nonan-2-yl)-2-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-2,7-naphthyridin-1-one?

The InChIKey is JOZGPXNKRQCLJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H39N7O/c1-30(2)8-13-35(14-9-30)17-23-3-4-28-34-24(20-37(28)18-23)19-36-12-5-25-26(29(36)39)15-33-16-27(25)38-21-31(22-38)6-10-32-11-7-31/h3-5,12,15-16,18,20,32H,6-11,13-14,17,19,21-22H2,1-2H3.

What are the key properties of 5-(2,7-diazaspiro[3.5]nonan-2-yl)-2-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-2,7-naphthyridin-1-one?

5-(2,7-diazaspiro[3.5]nonan-2-yl)-2-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-2,7-naphthyridin-1-one has a molecular weight of 525.70 g/mol, XLogP of 3.90, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(2,7-diazaspiro[3.5]nonan-2-yl)-2-[[6-[(4,4-dimethylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-2,7-naphthyridin-1-one is sourced from PubChem (CID 168970918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).