3-[5-[4-(3,5,6-trimethyl-2-pyridinyl)piperazine-1-carbonyl]-2-pyridinyl]-1,3-oxazolidin-2-one

C21H25N5O3 — CID 58484509

About 3-[5-[4-(3,5,6-trimethyl-2-pyridinyl)piperazine-1-carbonyl]-2-pyridinyl]-1,3-oxazolidin-2-one

3-[5-[4-(3,5,6-trimethyl-2-pyridinyl)piperazine-1-carbonyl]-2-pyridinyl]-1,3-oxazolidin-2-one (PubChem CID 58484509) has the molecular formula C21H25N5O3 and a molecular weight of 395.46 g/mol. Its IUPAC name is 3-[5-[4-(3,5,6-trimethyl-2-pyridinyl)piperazine-1-carbonyl]-2-pyridinyl]-1,3-oxazolidin-2-one.

Molecular Properties

• Compound Name: 3-[5-[4-(3,5,6-trimethyl-2-pyridinyl)piperazine-1-carbonyl]-2-pyridinyl]-1,3-oxazolidin-2-one
• PubChem CID: 58484509
• Molecular Formula: C21H25N5O3
• Molecular Weight: 395.46 g/mol
• Exact Mass: 395.20
• IUPAC Name: 3-[5-[4-(3,5,6-trimethyl-2-pyridinyl)piperazine-1-carbonyl]-2-pyridinyl]-1,3-oxazolidin-2-one
• SMILES: Cc1cc(C)c(N2CCN(C(=O)c3ccc(N4CCOC4=O)nc3)CC2)nc1C
• InChI: InChI=1S/C21H25N5O3/c1-14-12-15(2)19(23-16(14)3)24-6-8-25(9-7-24)20(27)17-4-5-18(22-13-17)26-10-11-29-21(26)28/h4-5,12-13H,6-11H2,1-3H3
• InChIKey: OFLJSTGUPKJZAM-UHFFFAOYSA-N
• XLogP: 2.32
• TPSA: 78.87 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	395.46
LogP ≤ 5	2.32
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-[5-[4-(3,5,6-trimethyl-2-pyridinyl)piperazine-1-carbonyl]-2-pyridinyl]-1,3-oxazolidin-2-one?

The IUPAC name of 3-[5-[4-(3,5,6-trimethyl-2-pyridinyl)piperazine-1-carbonyl]-2-pyridinyl]-1,3-oxazolidin-2-one (CID 58484509) is 3-[5-[4-(3,5,6-trimethyl-2-pyridinyl)piperazine-1-carbonyl]-2-pyridinyl]-1,3-oxazolidin-2-one.

What is the SMILES notation for 3-[5-[4-(3,5,6-trimethyl-2-pyridinyl)piperazine-1-carbonyl]-2-pyridinyl]-1,3-oxazolidin-2-one?

The canonical SMILES for 3-[5-[4-(3,5,6-trimethyl-2-pyridinyl)piperazine-1-carbonyl]-2-pyridinyl]-1,3-oxazolidin-2-one is Cc1cc(C)c(N2CCN(C(=O)c3ccc(N4CCOC4=O)nc3)CC2)nc1C.

What is the InChIKey of 3-[5-[4-(3,5,6-trimethyl-2-pyridinyl)piperazine-1-carbonyl]-2-pyridinyl]-1,3-oxazolidin-2-one?

The InChIKey is OFLJSTGUPKJZAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O3/c1-14-12-15(2)19(23-16(14)3)24-6-8-25(9-7-24)20(27)17-4-5-18(22-13-17)26-10-11-29-21(26)28/h4-5,12-13H,6-11H2,1-3H3.

What are the key properties of 3-[5-[4-(3,5,6-trimethyl-2-pyridinyl)piperazine-1-carbonyl]-2-pyridinyl]-1,3-oxazolidin-2-one?

3-[5-[4-(3,5,6-trimethyl-2-pyridinyl)piperazine-1-carbonyl]-2-pyridinyl]-1,3-oxazolidin-2-one has a molecular weight of 395.46 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[5-[4-(3,5,6-trimethyl-2-pyridinyl)piperazine-1-carbonyl]-2-pyridinyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 58484509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).