N-[(2R)-1-chlorohexan-2-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride

C22H25Cl2F2N3O2 — CID 118389643

About N-[(2R)-1-chlorohexan-2-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride

N-[(2R)-1-chlorohexan-2-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride (PubChem CID 118389643) has the molecular formula C22H25Cl2F2N3O2 and a molecular weight of 472.36 g/mol. Its IUPAC name is N-[(2R)-1-chlorohexan-2-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride.

Molecular Properties

• Compound Name: N-[(2R)-1-chlorohexan-2-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride
• PubChem CID: 118389643
• Molecular Formula: C22H25Cl2F2N3O2
• Molecular Weight: 472.36 g/mol
• Exact Mass: 471.13
• IUPAC Name: N-[(2R)-1-chlorohexan-2-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride
• SMILES: CCCC[C@H](CCl)NC(=O)c1c(C)nc2c(OCc3c(F)cccc3F)cccn12.Cl
• InChI: InChI=1S/C22H24ClF2N3O2.ClH/c1-3-4-7-15(12-23)27-22(29)20-14(2)26-21-19(10-6-11-28(20)21)30-13-16-17(24)8-5-9-18(16)25;/h5-6,8-11,15H,3-4,7,12-13H2,1-2H3,(H,27,29);1H/t15-;/m1./s1
• InChIKey: AZEWKFBGODHUKU-XFULWGLBSA-N
• XLogP: 5.45
• TPSA: 55.63 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 9
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	472.36
LogP ≤ 5	5.45
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-chlorohexan-2-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride?

The IUPAC name of N-[(2R)-1-chlorohexan-2-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride (CID 118389643) is N-[(2R)-1-chlorohexan-2-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride.

What is the SMILES notation for N-[(2R)-1-chlorohexan-2-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride?

The canonical SMILES for N-[(2R)-1-chlorohexan-2-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride is CCCC[C@H](CCl)NC(=O)c1c(C)nc2c(OCc3c(F)cccc3F)cccn12.Cl.

What is the InChIKey of N-[(2R)-1-chlorohexan-2-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride?

The InChIKey is AZEWKFBGODHUKU-XFULWGLBSA-N. The full InChI is InChI=1S/C22H24ClF2N3O2.ClH/c1-3-4-7-15(12-23)27-22(29)20-14(2)26-21-19(10-6-11-28(20)21)30-13-16-17(24)8-5-9-18(16)25;/h5-6,8-11,15H,3-4,7,12-13H2,1-2H3,(H,27,29);1H/t15-;/m1./s1.

What are the key properties of N-[(2R)-1-chlorohexan-2-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride?

N-[(2R)-1-chlorohexan-2-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride has a molecular weight of 472.36 g/mol, XLogP of 5.45, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(2R)-1-chlorohexan-2-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride is sourced from PubChem (CID 118389643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).