3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one

C15H22N4O2 — CID 124977703

IUPAC3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one
SMILESCC(C)N1CCC[C@@H](c2cncc(N3CCOC3=O)n2)C1
InChIInChI=1S/C15H22N4O2/c1-11(2)18-5-3-4-12(10-18)13-8-16-9-14(17-13)19-6-7-21-15(19)20/h8-9,11-12H,3-7,10H2,1-2H3/t12-/m1/s1
InChIKeyLOJOGOHTWCXGJK-GFCCVEGCSA-N
MW290.37 g/mol
LogP2.02
Rot. Bonds3

About 3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one

3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one (PubChem CID 124977703) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one
PubChem CID124977703
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one
SMILESCC(C)N1CCC[C@@H](c2cncc(N3CCOC3=O)n2)C1
InChIInChI=1S/C15H22N4O2/c1-11(2)18-5-3-4-12(10-18)13-8-16-9-14(17-13)19-6-7-21-15(19)20/h8-9,11-12H,3-7,10H2,1-2H3/t12-/m1/s1
InChIKeyLOJOGOHTWCXGJK-GFCCVEGCSA-N
XLogP2.02
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one (CID 124977703) is 3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one is CC(C)N1CCC[C@@H](c2cncc(N3CCOC3=O)n2)C1.
What is the InChIKey of 3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one?
The InChIKey is LOJOGOHTWCXGJK-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-11(2)18-5-3-4-12(10-18)13-8-16-9-14(17-13)19-6-7-21-15(19)20/h8-9,11-12H,3-7,10H2,1-2H3/t12-/m1/s1.
What are the key properties of 3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one?
3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one has a molecular weight of 290.37 g/mol, XLogP of 2.02, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazin-2-yl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 124977703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).