N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide

C24H24F4N6O4 — CID 90192608

About N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide

N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 90192608) has the molecular formula C24H24F4N6O4 and a molecular weight of 536.49 g/mol. Its IUPAC name is N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
• PubChem CID: 90192608
• Molecular Formula: C24H24F4N6O4
• Molecular Weight: 536.49 g/mol
• Exact Mass: 536.18
• IUPAC Name: N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
• SMILES: Cc1nc2c(OCc3c(F)cccc3F)cccn2c1C(=O)NC1(c2nn(C(F)F)[nH]2)COC(C)(C)OC1
• InChI: InChI=1S/C24H24F4N6O4/c1-13-18(20(35)30-24(11-37-23(2,3)38-12-24)21-31-34(32-21)22(27)28)33-9-5-8-17(19(33)29-13)36-10-14-15(25)6-4-7-16(14)26/h4-9,22H,10-12H2,1-3H3,(H,30,35)(H,31,32)
• InChIKey: ANXKDLAXRGDUTA-UHFFFAOYSA-N
• XLogP: 3.83
• TPSA: 107.70 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 8
• Rotatable Bonds: 7
• Heavy Atoms: 38
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	536.49
LogP ≤ 5	3.83
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?

The IUPAC name of N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (CID 90192608) is N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.

What is the SMILES notation for N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?

The canonical SMILES for N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is Cc1nc2c(OCc3c(F)cccc3F)cccn2c1C(=O)NC1(c2nn(C(F)F)[nH]2)COC(C)(C)OC1.

What is the InChIKey of N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?

The InChIKey is ANXKDLAXRGDUTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24F4N6O4/c1-13-18(20(35)30-24(11-37-23(2,3)38-12-24)21-31-34(32-21)22(27)28)33-9-5-8-17(19(33)29-13)36-10-14-15(25)6-4-7-16(14)26/h4-9,22H,10-12H2,1-3H3,(H,30,35)(H,31,32).

What are the key properties of N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?

N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 536.49 g/mol, XLogP of 3.83, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-[2-(difluoromethyl)-1H-triazet-4-yl]-2,2-dimethyl-1,3-dioxan-5-yl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 90192608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).