1-[6-[[5-cyclopropyl-3-(6-methylpyridazin-3-yl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone;6-[[5-cyclopropyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide;1-[6-[[5-(fluoromethyl)-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone

C68H73FN14O12 — CID 167640298

About 1-[6-[[5-cyclopropyl-3-(6-methylpyridazin-3-yl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone;6-[[5-cyclopropyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide;1-[6-[[5-(fluoromethyl)-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone

1-[6-[[5-cyclopropyl-3-(6-methylpyridazin-3-yl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone;6-[[5-cyclopropyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide;1-[6-[[5-(fluoromethyl)-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone (PubChem CID 167640298) has the molecular formula C68H73FN14O12 and a molecular weight of 1297.42 g/mol. Its IUPAC name is 1-[6-[[5-cyclopropyl-3-(6-methylpyridazin-3-yl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone;6-[[5-cyclopropyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide;1-[6-[[5-(fluoromethyl)-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone.

Molecular Properties

• Compound Name: 1-[6-[[5-cyclopropyl-3-(6-methylpyridazin-3-yl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone;6-[[5-cyclopropyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide;1-[6-[[5-(fluoromethyl)-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone
• PubChem CID: 167640298
• Molecular Formula: C68H73FN14O12
• Molecular Weight: 1297.42 g/mol
• Exact Mass: 1296.55
• IUPAC Name: 1-[6-[[5-cyclopropyl-3-(6-methylpyridazin-3-yl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone;6-[[5-cyclopropyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide;1-[6-[[5-(fluoromethyl)-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone
• SMILES: Cc1ccc(-c2noc(C3CC3)c2COc2ccc(C(=O)CC3CCOCC3)nn2)nn1.Cc1ccc(-c2noc(C3CC3)c2COc2ccc(C(=O)NC3CCOCC3)nn2)cn1.Cc1ccc(-c2noc(CF)c2COc2ccc(C(=O)CC3CCOCC3)nn2)cn1
• InChI: InChI=1S/2C23H25N5O4.C22H23FN4O4/c1-14-2-5-19(26-24-14)22-17(23(32-28-22)16-3-4-16)13-31-21-7-6-18(25-27-21)20(29)12-15-8-10-30-11-9-15;1-14-2-3-16(12-24-14)21-18(22(32-28-21)15-4-5-15)13-31-20-7-6-19(26-27-20)23(29)25-17-8-10-30-11-9-17;1-14-2-3-16(12-24-14)22-17(20(11-23)31-27-22)13-30-21-5-4-18(25-26-21)19(28)10-15-6-8-29-9-7-15/h2,5-7,15-16H,3-4,8-13H2,1H3;2-3,6-7,12,15,17H,4-5,8-11,13H2,1H3,(H,25,29);2-5,12,15H,6-11,13H2,1H3
• InChIKey: PBNVTOFOHQTFHZ-UHFFFAOYSA-N
• XLogP: 10.77
• TPSA: 325.61 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 25
• Rotatable Bonds: 23
• Heavy Atoms: 95
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1297.42
LogP ≤ 5	10.77
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of 1-[6-[[5-cyclopropyl-3-(6-methylpyridazin-3-yl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone;6-[[5-cyclopropyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide;1-[6-[[5-(fluoromethyl)-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone?

The IUPAC name of 1-[6-[[5-cyclopropyl-3-(6-methylpyridazin-3-yl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone;6-[[5-cyclopropyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide;1-[6-[[5-(fluoromethyl)-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone (CID 167640298) is 1-[6-[[5-cyclopropyl-3-(6-methylpyridazin-3-yl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone;6-[[5-cyclopropyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide;1-[6-[[5-(fluoromethyl)-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone.

What is the SMILES notation for 1-[6-[[5-cyclopropyl-3-(6-methylpyridazin-3-yl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone;6-[[5-cyclopropyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide;1-[6-[[5-(fluoromethyl)-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone?

The canonical SMILES for 1-[6-[[5-cyclopropyl-3-(6-methylpyridazin-3-yl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone;6-[[5-cyclopropyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide;1-[6-[[5-(fluoromethyl)-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone is Cc1ccc(-c2noc(C3CC3)c2COc2ccc(C(=O)CC3CCOCC3)nn2)nn1.Cc1ccc(-c2noc(C3CC3)c2COc2ccc(C(=O)NC3CCOCC3)nn2)cn1.Cc1ccc(-c2noc(CF)c2COc2ccc(C(=O)CC3CCOCC3)nn2)cn1.

What is the InChIKey of 1-[6-[[5-cyclopropyl-3-(6-methylpyridazin-3-yl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone;6-[[5-cyclopropyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide;1-[6-[[5-(fluoromethyl)-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone?

The InChIKey is PBNVTOFOHQTFHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C23H25N5O4.C22H23FN4O4/c1-14-2-5-19(26-24-14)22-17(23(32-28-22)16-3-4-16)13-31-21-7-6-18(25-27-21)20(29)12-15-8-10-30-11-9-15;1-14-2-3-16(12-24-14)21-18(22(32-28-21)15-4-5-15)13-31-20-7-6-19(26-27-20)23(29)25-17-8-10-30-11-9-17;1-14-2-3-16(12-24-14)22-17(20(11-23)31-27-22)13-30-21-5-4-18(25-26-21)19(28)10-15-6-8-29-9-7-15/h2,5-7,15-16H,3-4,8-13H2,1H3;2-3,6-7,12,15,17H,4-5,8-11,13H2,1H3,(H,25,29);2-5,12,15H,6-11,13H2,1H3.

What are the key properties of 1-[6-[[5-cyclopropyl-3-(6-methylpyridazin-3-yl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone;6-[[5-cyclopropyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide;1-[6-[[5-(fluoromethyl)-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone?

1-[6-[[5-cyclopropyl-3-(6-methylpyridazin-3-yl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone;6-[[5-cyclopropyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide;1-[6-[[5-(fluoromethyl)-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone has a molecular weight of 1297.42 g/mol, XLogP of 10.77, 23 rotatable bonds, 1 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[6-[[5-cyclopropyl-3-(6-methylpyridazin-3-yl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone;6-[[5-cyclopropyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide;1-[6-[[5-(fluoromethyl)-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazin-3-yl]-2-(oxan-4-yl)ethanone is sourced from PubChem (CID 167640298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).