2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;bis(2-[(2-hydroxyethylamino)methyl]-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide)

C78H74ClN11O6 — CID 123638420

About 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;bis(2-[(2-hydroxyethylamino)methyl]-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide)

2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;bis(2-[(2-hydroxyethylamino)methyl]-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide) (PubChem CID 123638420) has the molecular formula C78H74ClN11O6 and a molecular weight of 1296.97 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;bis(2-[(2-hydroxyethylamino)methyl]-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide).

Molecular Properties

• Compound Name: 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;bis(2-[(2-hydroxyethylamino)methyl]-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide)
• PubChem CID: 123638420
• Molecular Formula: C78H74ClN11O6
• Molecular Weight: 1296.97 g/mol
• Exact Mass: 1295.55
• IUPAC Name: 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;bis(2-[(2-hydroxyethylamino)methyl]-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide)
• SMILES: Cc1ccc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(CNCCO)c1.Cc1ccc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(CNCCO)c1.Cc1ccc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Oc2ccc(Cl)cc2)c1
• InChI: InChI=1S/C28H22ClN3O2.2C25H26N4O2/c1-18-5-14-24(26(16-18)34-23-12-8-21(29)9-13-23)28(33)30-22-10-6-20(7-11-22)25-17-32-15-3-4-19(2)27(32)31-25;2*1-17-5-10-22(20(14-17)15-26-11-13-30)25(31)27-21-8-6-19(7-9-21)23-16-29-12-3-4-18(2)24(29)28-23/h3-17H,1-2H3,(H,30,33);2*3-10,12,14,16,26,30H,11,13,15H2,1-2H3,(H,27,31)
• InChIKey: IPUTYMXTCRVWPX-UHFFFAOYSA-N
• XLogP: 15.22
• TPSA: 212.95 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 14
• Rotatable Bonds: 19
• Heavy Atoms: 96
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1296.97
LogP ≤ 5	15.22
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;bis(2-[(2-hydroxyethylamino)methyl]-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide)?

The IUPAC name of 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;bis(2-[(2-hydroxyethylamino)methyl]-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide) (CID 123638420) is 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;bis(2-[(2-hydroxyethylamino)methyl]-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide).

What is the SMILES notation for 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;bis(2-[(2-hydroxyethylamino)methyl]-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide)?

The canonical SMILES for 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;bis(2-[(2-hydroxyethylamino)methyl]-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide) is Cc1ccc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(CNCCO)c1.Cc1ccc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(CNCCO)c1.Cc1ccc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Oc2ccc(Cl)cc2)c1.

What is the InChIKey of 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;bis(2-[(2-hydroxyethylamino)methyl]-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide)?

The InChIKey is IPUTYMXTCRVWPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H22ClN3O2.2C25H26N4O2/c1-18-5-14-24(26(16-18)34-23-12-8-21(29)9-13-23)28(33)30-22-10-6-20(7-11-22)25-17-32-15-3-4-19(2)27(32)31-25;2*1-17-5-10-22(20(14-17)15-26-11-13-30)25(31)27-21-8-6-19(7-9-21)23-16-29-12-3-4-18(2)24(29)28-23/h3-17H,1-2H3,(H,30,33);2*3-10,12,14,16,26,30H,11,13,15H2,1-2H3,(H,27,31).

What are the key properties of 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;bis(2-[(2-hydroxyethylamino)methyl]-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide)?

2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;bis(2-[(2-hydroxyethylamino)methyl]-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide) has a molecular weight of 1296.97 g/mol, XLogP of 15.22, 19 rotatable bonds, 7 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4-chlorophenoxy)-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide;bis(2-[(2-hydroxyethylamino)methyl]-4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide) is sourced from PubChem (CID 123638420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).