5-methyl-3-[(2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole

C15H20N4O — CID 24916056

About 5-methyl-3-[(2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole

5-methyl-3-[(2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole (PubChem CID 24916056) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 5-methyl-3-[(2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole.

Molecular Properties

• Compound Name: 5-methyl-3-[(2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole
• PubChem CID: 24916056
• Molecular Formula: C15H20N4O
• Molecular Weight: 272.35 g/mol
• Exact Mass: 272.16
• IUPAC Name: 5-methyl-3-[(2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole
• SMILES: CCCc1ncc2c(n1)CCN(Cc1cc(C)on1)C2
• InChI: InChI=1S/C15H20N4O/c1-3-4-15-16-8-12-9-19(6-5-14(12)17-15)10-13-7-11(2)20-18-13/h7-8H,3-6,9-10H2,1-2H3
• InChIKey: DAHIUWXVWLNLJZ-UHFFFAOYSA-N
• XLogP: 2.28
• TPSA: 55.05 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	272.35
LogP ≤ 5	2.28
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-[(2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole?

The IUPAC name of 5-methyl-3-[(2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole (CID 24916056) is 5-methyl-3-[(2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole.

What is the SMILES notation for 5-methyl-3-[(2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole?

The canonical SMILES for 5-methyl-3-[(2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole is CCCc1ncc2c(n1)CCN(Cc1cc(C)on1)C2.

What is the InChIKey of 5-methyl-3-[(2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole?

The InChIKey is DAHIUWXVWLNLJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-3-4-15-16-8-12-9-19(6-5-14(12)17-15)10-13-7-11(2)20-18-13/h7-8H,3-6,9-10H2,1-2H3.

What are the key properties of 5-methyl-3-[(2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole?

5-methyl-3-[(2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole has a molecular weight of 272.35 g/mol, XLogP of 2.28, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 5-methyl-3-[(2-propyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]-1,2-oxazole is sourced from PubChem (CID 24916056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).