4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine

C17H13ClN6 — CID 66679435

About 4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine

4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine (PubChem CID 66679435) has the molecular formula C17H13ClN6 and a molecular weight of 336.79 g/mol. Its IUPAC name is 4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine.

Molecular Properties

• Compound Name: 4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine
• PubChem CID: 66679435
• Molecular Formula: C17H13ClN6
• Molecular Weight: 336.79 g/mol
• Exact Mass: 336.09
• IUPAC Name: 4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine
• SMILES: Cc1cccc(-c2nc3ccc(Cl)cn3c2-c2ccnc(N)n2)n1
• InChI: InChI=1S/C17H13ClN6/c1-10-3-2-4-12(21-10)15-16(13-7-8-20-17(19)22-13)24-9-11(18)5-6-14(24)23-15/h2-9H,1H3,(H2,19,20,22)
• InChIKey: XBQDWPKMVWEZHR-UHFFFAOYSA-N
• XLogP: 3.40
• TPSA: 81.99 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 2
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	336.79
LogP ≤ 5	3.40
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine?

The IUPAC name of 4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine (CID 66679435) is 4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine.

What is the SMILES notation for 4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine?

The canonical SMILES for 4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine is Cc1cccc(-c2nc3ccc(Cl)cn3c2-c2ccnc(N)n2)n1.

What is the InChIKey of 4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine?

The InChIKey is XBQDWPKMVWEZHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClN6/c1-10-3-2-4-12(21-10)15-16(13-7-8-20-17(19)22-13)24-9-11(18)5-6-14(24)23-15/h2-9H,1H3,(H2,19,20,22).

What are the key properties of 4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine?

4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine has a molecular weight of 336.79 g/mol, XLogP of 3.40, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine is sourced from PubChem (CID 66679435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).