2-methyl-7-naphthalen-1-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine

C₁₇H₁₇N₃ — CID 136710492

About 2-methyl-7-naphthalen-1-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine

2-methyl-7-naphthalen-1-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine (PubChem CID 136710492) has the molecular formula C₁₇H₁₇N₃ and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-methyl-7-naphthalen-1-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine.

Molecular Properties

• Compound Name: 2-methyl-7-naphthalen-1-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine
• PubChem CID: 136710492
• Molecular Formula: C₁₇H₁₇N₃
• Molecular Weight: 263.34 g/mol
• Exact Mass: 263.14
• IUPAC Name: 2-methyl-7-naphthalen-1-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine
• SMILES: Cc1cn2c(n1)NC(c1cccc3ccccc13)CC2
• InChI: InChI=1S/C17H17N3/c1-12-11-20-10-9-16(19-17(20)18-12)15-8-4-6-13-5-2-3-7-14(13)15/h2-8,11,16H,9-10H2,1H3,(H,18,19)
• InChIKey: CCSHHTRPPTVGPX-UHFFFAOYSA-N
• XLogP: 3.90
• TPSA: 29.85 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 1
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	263.34
LogP ≤ 5	3.90
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 2-methyl-7-naphthalen-1-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine?

The IUPAC name of 2-methyl-7-naphthalen-1-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine (CID 136710492) is 2-methyl-7-naphthalen-1-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine.

What is the SMILES notation for 2-methyl-7-naphthalen-1-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine?

The canonical SMILES for 2-methyl-7-naphthalen-1-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine is Cc1cn2c(n1)NC(c1cccc3ccccc13)CC2.

What is the InChIKey of 2-methyl-7-naphthalen-1-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine?

The InChIKey is CCSHHTRPPTVGPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3/c1-12-11-20-10-9-16(19-17(20)18-12)15-8-4-6-13-5-2-3-7-14(13)15/h2-8,11,16H,9-10H2,1H3,(H,18,19).

What are the key properties of 2-methyl-7-naphthalen-1-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine?

2-methyl-7-naphthalen-1-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine has a molecular weight of 263.34 g/mol, XLogP of 3.90, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-methyl-7-naphthalen-1-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine is sourced from PubChem (CID 136710492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 136710492 — identifiers, structure, computed properties (public domain)

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