2-cyclobutyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-cyclopentyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4,5-dimethyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(3-methylphenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(1-methylpyrazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(6-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone

C103H94N18O12 — CID 158328948

About 2-cyclobutyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-cyclopentyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4,5-dimethyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(3-methylphenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(1-methylpyrazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(6-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone

2-cyclobutyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-cyclopentyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4,5-dimethyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(3-methylphenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(1-methylpyrazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(6-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone (PubChem CID 158328948) has the molecular formula C103H94N18O12 and a molecular weight of 1776.00 g/mol. Its IUPAC name is 2-cyclobutyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-cyclopentyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4,5-dimethyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(3-methylphenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(1-methylpyrazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(6-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone.

Molecular Properties

• Compound Name: 2-cyclobutyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-cyclopentyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4,5-dimethyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(3-methylphenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(1-methylpyrazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(6-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone
• PubChem CID: 158328948
• Molecular Formula: C103H94N18O12
• Molecular Weight: 1776.00 g/mol
• Exact Mass: 1774.73
• IUPAC Name: 2-cyclobutyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-cyclopentyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4,5-dimethyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(3-methylphenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(1-methylpyrazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(6-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone
• SMILES: Cc1cccc(CC(=O)c2cc(Oc3cccnc3)ccn2)c1.Cc1cccc(CC(=O)c2cc(Oc3cncnc3)ccn2)n1.Cc1cnc(CC(=O)c2cc(Oc3cncnc3)ccn2)cc1C.Cn1ccc(CC(=O)c2cc(Oc3cccnc3)ccn2)n1.O=C(CC1CCC1)c1cc(Oc2cccnc2)ccn1.O=C(CC1CCCC1)c1cc(Oc2cccnc2)ccn1
• InChI: InChI=1S/C19H16N2O2.C18H16N4O2.C17H14N4O2.C17H18N2O2.C16H14N4O2.C16H16N2O2/c1-14-4-2-5-15(10-14)11-19(22)18-12-16(7-9-21-18)23-17-6-3-8-20-13-17;1-12-5-14(22-8-13(12)2)6-18(23)17-7-15(3-4-21-17)24-16-9-19-11-20-10-16;1-12-3-2-4-13(21-12)7-17(22)16-8-14(5-6-20-16)23-15-9-18-11-19-10-15;20-17(10-13-4-1-2-5-13)16-11-14(7-9-19-16)21-15-6-3-8-18-12-15;1-20-8-5-12(19-20)9-16(21)15-10-13(4-7-18-15)22-14-3-2-6-17-11-14;19-16(9-12-3-1-4-12)15-10-13(6-8-18-15)20-14-5-2-7-17-11-14/h2-10,12-13H,11H2,1H3;3-5,7-11H,6H2,1-2H3;2-6,8-11H,7H2,1H3;3,6-9,11-13H,1-2,4-5,10H2;2-8,10-11H,9H2,1H3;2,5-8,10-12H,1,3-4,9H2
• InChIKey: GPTQDEUOHSWQKX-UHFFFAOYSA-N
• XLogP: 20.00
• TPSA: 381.86 Ų
• H-Bond Acceptors: 30
• Rotatable Bonds: 30
• Heavy Atoms: 133
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1776.00
LogP ≤ 5	20.00
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-cyclopentyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4,5-dimethyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(3-methylphenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(1-methylpyrazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(6-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone?

The IUPAC name of 2-cyclobutyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-cyclopentyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4,5-dimethyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(3-methylphenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(1-methylpyrazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(6-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone (CID 158328948) is 2-cyclobutyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-cyclopentyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4,5-dimethyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(3-methylphenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(1-methylpyrazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(6-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone.

What is the SMILES notation for 2-cyclobutyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-cyclopentyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4,5-dimethyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(3-methylphenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(1-methylpyrazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(6-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone?

The canonical SMILES for 2-cyclobutyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-cyclopentyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4,5-dimethyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(3-methylphenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(1-methylpyrazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(6-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone is Cc1cccc(CC(=O)c2cc(Oc3cccnc3)ccn2)c1.Cc1cccc(CC(=O)c2cc(Oc3cncnc3)ccn2)n1.Cc1cnc(CC(=O)c2cc(Oc3cncnc3)ccn2)cc1C.Cn1ccc(CC(=O)c2cc(Oc3cccnc3)ccn2)n1.O=C(CC1CCC1)c1cc(Oc2cccnc2)ccn1.O=C(CC1CCCC1)c1cc(Oc2cccnc2)ccn1.

What is the InChIKey of 2-cyclobutyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-cyclopentyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4,5-dimethyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(3-methylphenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(1-methylpyrazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(6-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone?

The InChIKey is GPTQDEUOHSWQKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2.C18H16N4O2.C17H14N4O2.C17H18N2O2.C16H14N4O2.C16H16N2O2/c1-14-4-2-5-15(10-14)11-19(22)18-12-16(7-9-21-18)23-17-6-3-8-20-13-17;1-12-5-14(22-8-13(12)2)6-18(23)17-7-15(3-4-21-17)24-16-9-19-11-20-10-16;1-12-3-2-4-13(21-12)7-17(22)16-8-14(5-6-20-16)23-15-9-18-11-19-10-15;20-17(10-13-4-1-2-5-13)16-11-14(7-9-19-16)21-15-6-3-8-18-12-15;1-20-8-5-12(19-20)9-16(21)15-10-13(4-7-18-15)22-14-3-2-6-17-11-14;19-16(9-12-3-1-4-12)15-10-13(6-8-18-15)20-14-5-2-7-17-11-14/h2-10,12-13H,11H2,1H3;3-5,7-11H,6H2,1-2H3;2-6,8-11H,7H2,1H3;3,6-9,11-13H,1-2,4-5,10H2;2-8,10-11H,9H2,1H3;2,5-8,10-12H,1,3-4,9H2.

What are the key properties of 2-cyclobutyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-cyclopentyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4,5-dimethyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(3-methylphenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(1-methylpyrazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(6-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone?

2-cyclobutyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-cyclopentyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4,5-dimethyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(3-methylphenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(1-methylpyrazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(6-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone has a molecular weight of 1776.00 g/mol, XLogP of 20.00, 30 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 2-cyclobutyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-cyclopentyl-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4,5-dimethyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(3-methylphenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(1-methylpyrazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(6-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone is sourced from PubChem (CID 158328948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).