6-[(2,7-dimethoxyquinolin-3-yl)methyl]-2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine

C22H26N4O2 — CID 24916182

About 6-[(2,7-dimethoxyquinolin-3-yl)methyl]-2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine

6-[(2,7-dimethoxyquinolin-3-yl)methyl]-2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine (PubChem CID 24916182) has the molecular formula C22H26N4O2 and a molecular weight of 378.48 g/mol. Its IUPAC name is 6-[(2,7-dimethoxyquinolin-3-yl)methyl]-2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine.

Molecular Properties

• Compound Name: 6-[(2,7-dimethoxyquinolin-3-yl)methyl]-2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
• PubChem CID: 24916182
• Molecular Formula: C22H26N4O2
• Molecular Weight: 378.48 g/mol
• Exact Mass: 378.21
• IUPAC Name: 6-[(2,7-dimethoxyquinolin-3-yl)methyl]-2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
• SMILES: CCCc1ncc2c(n1)CCN(Cc1cc3ccc(OC)cc3nc1OC)C2
• InChI: InChI=1S/C22H26N4O2/c1-4-5-21-23-12-17-14-26(9-8-19(17)24-21)13-16-10-15-6-7-18(27-2)11-20(15)25-22(16)28-3/h6-7,10-12H,4-5,8-9,13-14H2,1-3H3
• InChIKey: UVYXZAZTFOSJGQ-UHFFFAOYSA-N
• XLogP: 3.55
• TPSA: 60.37 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	378.48
LogP ≤ 5	3.55
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 6-[(2,7-dimethoxyquinolin-3-yl)methyl]-2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?

The IUPAC name of 6-[(2,7-dimethoxyquinolin-3-yl)methyl]-2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine (CID 24916182) is 6-[(2,7-dimethoxyquinolin-3-yl)methyl]-2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine.

What is the SMILES notation for 6-[(2,7-dimethoxyquinolin-3-yl)methyl]-2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?

The canonical SMILES for 6-[(2,7-dimethoxyquinolin-3-yl)methyl]-2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine is CCCc1ncc2c(n1)CCN(Cc1cc3ccc(OC)cc3nc1OC)C2.

What is the InChIKey of 6-[(2,7-dimethoxyquinolin-3-yl)methyl]-2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?

The InChIKey is UVYXZAZTFOSJGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O2/c1-4-5-21-23-12-17-14-26(9-8-19(17)24-21)13-16-10-15-6-7-18(27-2)11-20(15)25-22(16)28-3/h6-7,10-12H,4-5,8-9,13-14H2,1-3H3.

What are the key properties of 6-[(2,7-dimethoxyquinolin-3-yl)methyl]-2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine?

6-[(2,7-dimethoxyquinolin-3-yl)methyl]-2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine has a molecular weight of 378.48 g/mol, XLogP of 3.55, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[(2,7-dimethoxyquinolin-3-yl)methyl]-2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine is sourced from PubChem (CID 24916182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).