6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-cyclobutyl-5-methylpyridin-2-amine;6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-methyl-N-piperidin-4-ylpyridin-2-amine;[3-[6-(cyclobutylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-7-yl]methanol

C52H55Cl2N13O — CID 164973659

About 6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-cyclobutyl-5-methylpyridin-2-amine;6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-methyl-N-piperidin-4-ylpyridin-2-amine;[3-[6-(cyclobutylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-7-yl]methanol

6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-cyclobutyl-5-methylpyridin-2-amine;6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-methyl-N-piperidin-4-ylpyridin-2-amine;[3-[6-(cyclobutylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-7-yl]methanol (PubChem CID 164973659) has the molecular formula C52H55Cl2N13O and a molecular weight of 949.01 g/mol. Its IUPAC name is 6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-cyclobutyl-5-methylpyridin-2-amine;6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-methyl-N-piperidin-4-ylpyridin-2-amine;[3-[6-(cyclobutylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-7-yl]methanol.

Molecular Properties

• Compound Name: 6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-cyclobutyl-5-methylpyridin-2-amine;6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-methyl-N-piperidin-4-ylpyridin-2-amine;[3-[6-(cyclobutylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-7-yl]methanol
• PubChem CID: 164973659
• Molecular Formula: C52H55Cl2N13O
• Molecular Weight: 949.01 g/mol
• Exact Mass: 947.40
• IUPAC Name: 6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-cyclobutyl-5-methylpyridin-2-amine;6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-methyl-N-piperidin-4-ylpyridin-2-amine;[3-[6-(cyclobutylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-7-yl]methanol
• SMILES: CN(c1cccc(-c2cnc3ccc(Cl)cn23)n1)C1CCNCC1.Cc1ccc(NC2CCC2)nc1-c1cnc2ccc(Cl)cn12.OCc1ccn2c(-c3cccc(NC4CCC4)n3)cnc2c1
• InChI: InChI=1S/C18H20ClN5.C17H17ClN4.C17H18N4O/c1-23(14-7-9-20-10-8-14)18-4-2-3-15(22-18)16-11-21-17-6-5-13(19)12-24(16)17;1-11-5-7-15(20-13-3-2-4-13)21-17(11)14-9-19-16-8-6-12(18)10-22(14)16;22-11-12-7-8-21-15(10-18-17(21)9-12)14-5-2-6-16(20-14)19-13-3-1-4-13/h2-6,11-12,14,20H,7-10H2,1H3;5-10,13H,2-4H2,1H3,(H,20,21);2,5-10,13,22H,1,3-4,11H2,(H,19,20)
• InChIKey: DLVPJCNMWVWGMD-UHFFFAOYSA-N
• XLogP: 10.41
• TPSA: 150.13 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 14
• Rotatable Bonds: 10
• Heavy Atoms: 68
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	949.01
LogP ≤ 5	10.41
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of 6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-cyclobutyl-5-methylpyridin-2-amine;6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-methyl-N-piperidin-4-ylpyridin-2-amine;[3-[6-(cyclobutylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-7-yl]methanol?

The IUPAC name of 6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-cyclobutyl-5-methylpyridin-2-amine;6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-methyl-N-piperidin-4-ylpyridin-2-amine;[3-[6-(cyclobutylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-7-yl]methanol (CID 164973659) is 6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-cyclobutyl-5-methylpyridin-2-amine;6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-methyl-N-piperidin-4-ylpyridin-2-amine;[3-[6-(cyclobutylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-7-yl]methanol.

What is the SMILES notation for 6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-cyclobutyl-5-methylpyridin-2-amine;6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-methyl-N-piperidin-4-ylpyridin-2-amine;[3-[6-(cyclobutylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-7-yl]methanol?

The canonical SMILES for 6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-cyclobutyl-5-methylpyridin-2-amine;6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-methyl-N-piperidin-4-ylpyridin-2-amine;[3-[6-(cyclobutylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-7-yl]methanol is CN(c1cccc(-c2cnc3ccc(Cl)cn23)n1)C1CCNCC1.Cc1ccc(NC2CCC2)nc1-c1cnc2ccc(Cl)cn12.OCc1ccn2c(-c3cccc(NC4CCC4)n3)cnc2c1.

What is the InChIKey of 6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-cyclobutyl-5-methylpyridin-2-amine;6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-methyl-N-piperidin-4-ylpyridin-2-amine;[3-[6-(cyclobutylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-7-yl]methanol?

The InChIKey is DLVPJCNMWVWGMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClN5.C17H17ClN4.C17H18N4O/c1-23(14-7-9-20-10-8-14)18-4-2-3-15(22-18)16-11-21-17-6-5-13(19)12-24(16)17;1-11-5-7-15(20-13-3-2-4-13)21-17(11)14-9-19-16-8-6-12(18)10-22(14)16;22-11-12-7-8-21-15(10-18-17(21)9-12)14-5-2-6-16(20-14)19-13-3-1-4-13/h2-6,11-12,14,20H,7-10H2,1H3;5-10,13H,2-4H2,1H3,(H,20,21);2,5-10,13,22H,1,3-4,11H2,(H,19,20).

What are the key properties of 6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-cyclobutyl-5-methylpyridin-2-amine;6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-methyl-N-piperidin-4-ylpyridin-2-amine;[3-[6-(cyclobutylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-7-yl]methanol?

6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-cyclobutyl-5-methylpyridin-2-amine;6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-methyl-N-piperidin-4-ylpyridin-2-amine;[3-[6-(cyclobutylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-7-yl]methanol has a molecular weight of 949.01 g/mol, XLogP of 10.41, 10 rotatable bonds, 4 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-cyclobutyl-5-methylpyridin-2-amine;6-(6-chloroimidazo[1,2-a]pyridin-3-yl)-N-methyl-N-piperidin-4-ylpyridin-2-amine;[3-[6-(cyclobutylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-7-yl]methanol is sourced from PubChem (CID 164973659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).