4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one

C15H21N3O2 — CID 110099068

IUPAC4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one
SMILESCC1COC(=O)N1c1cccc(C2CCN(C)CC2)n1
InChIInChI=1S/C15H21N3O2/c1-11-10-20-15(19)18(11)14-5-3-4-13(16-14)12-6-8-17(2)9-7-12/h3-5,11-12H,6-10H2,1-2H3
InChIKeyCSSUHZCLZUYVAD-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.24
Rot. Bonds2

About 4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one

4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one (PubChem CID 110099068) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one
PubChem CID110099068
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one
SMILESCC1COC(=O)N1c1cccc(C2CCN(C)CC2)n1
InChIInChI=1S/C15H21N3O2/c1-11-10-20-15(19)18(11)14-5-3-4-13(16-14)12-6-8-17(2)9-7-12/h3-5,11-12H,6-10H2,1-2H3
InChIKeyCSSUHZCLZUYVAD-UHFFFAOYSA-N
XLogP2.24
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one?
The IUPAC name of 4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one (CID 110099068) is 4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one is CC1COC(=O)N1c1cccc(C2CCN(C)CC2)n1.
What is the InChIKey of 4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one?
The InChIKey is CSSUHZCLZUYVAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-11-10-20-15(19)18(11)14-5-3-4-13(16-14)12-6-8-17(2)9-7-12/h3-5,11-12H,6-10H2,1-2H3.
What are the key properties of 4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one?
4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one has a molecular weight of 275.35 g/mol, XLogP of 2.24, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 110099068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).