3-[4-[4-(3,5-dicyclopropyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one;methoxyethane

C28H36N4O4 — CID 143982799

About 3-[4-[4-(3,5-dicyclopropyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one;methoxyethane

3-[4-[4-(3,5-dicyclopropyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one;methoxyethane (PubChem CID 143982799) has the molecular formula C28H36N4O4 and a molecular weight of 492.62 g/mol. Its IUPAC name is 3-[4-[4-(3,5-dicyclopropyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one;methoxyethane.

Molecular Properties

• Compound Name: 3-[4-[4-(3,5-dicyclopropyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one;methoxyethane
• PubChem CID: 143982799
• Molecular Formula: C28H36N4O4
• Molecular Weight: 492.62 g/mol
• Exact Mass: 492.27
• IUPAC Name: 3-[4-[4-(3,5-dicyclopropyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one;methoxyethane
• SMILES: CCOC.O=C(c1ccc(N2CCOC2=O)cc1)N1CCN(c2ncc(C3CC3)cc2C2CC2)CC1
• InChI: InChI=1S/C25H28N4O3.C3H8O/c30-24(19-5-7-21(8-6-19)29-13-14-32-25(29)31)28-11-9-27(10-12-28)23-22(18-3-4-18)15-20(16-26-23)17-1-2-17;1-3-4-2/h5-8,15-18H,1-4,9-14H2;3H2,1-2H3
• InChIKey: KVVQMIBLCCXLIS-UHFFFAOYSA-N
• XLogP: 4.41
• TPSA: 75.21 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	492.62
LogP ≤ 5	4.41
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-[4-[4-(3,5-dicyclopropyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one;methoxyethane?

The IUPAC name of 3-[4-[4-(3,5-dicyclopropyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one;methoxyethane (CID 143982799) is 3-[4-[4-(3,5-dicyclopropyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one;methoxyethane.

What is the SMILES notation for 3-[4-[4-(3,5-dicyclopropyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one;methoxyethane?

The canonical SMILES for 3-[4-[4-(3,5-dicyclopropyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one;methoxyethane is CCOC.O=C(c1ccc(N2CCOC2=O)cc1)N1CCN(c2ncc(C3CC3)cc2C2CC2)CC1.

What is the InChIKey of 3-[4-[4-(3,5-dicyclopropyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one;methoxyethane?

The InChIKey is KVVQMIBLCCXLIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N4O3.C3H8O/c30-24(19-5-7-21(8-6-19)29-13-14-32-25(29)31)28-11-9-27(10-12-28)23-22(18-3-4-18)15-20(16-26-23)17-1-2-17;1-3-4-2/h5-8,15-18H,1-4,9-14H2;3H2,1-2H3.

What are the key properties of 3-[4-[4-(3,5-dicyclopropyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one;methoxyethane?

3-[4-[4-(3,5-dicyclopropyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one;methoxyethane has a molecular weight of 492.62 g/mol, XLogP of 4.41, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[4-[4-(3,5-dicyclopropyl-2-pyridinyl)piperazine-1-carbonyl]phenyl]-1,3-oxazolidin-2-one;methoxyethane is sourced from PubChem (CID 143982799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).