1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one

C15H24N2O2 — CID 115082483

IUPAC1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one
SMILESCC(=O)Cc1coc(CC2CCN(C(C)C)CC2)n1
InChIInChI=1S/C15H24N2O2/c1-11(2)17-6-4-13(5-7-17)9-15-16-14(10-19-15)8-12(3)18/h10-11,13H,4-9H2,1-3H3
InChIKeyGONUTVULJKCWHJ-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.47
Rot. Bonds5

About 1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one

1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one (PubChem CID 115082483) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one.

Molecular Properties

Compound Name1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one
PubChem CID115082483
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one
SMILESCC(=O)Cc1coc(CC2CCN(C(C)C)CC2)n1
InChIInChI=1S/C15H24N2O2/c1-11(2)17-6-4-13(5-7-17)9-15-16-14(10-19-15)8-12(3)18/h10-11,13H,4-9H2,1-3H3
InChIKeyGONUTVULJKCWHJ-UHFFFAOYSA-N
XLogP2.47
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one?
The IUPAC name of 1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one (CID 115082483) is 1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one.
What is the SMILES notation for 1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one?
The canonical SMILES for 1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one is CC(=O)Cc1coc(CC2CCN(C(C)C)CC2)n1.
What is the InChIKey of 1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one?
The InChIKey is GONUTVULJKCWHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)17-6-4-13(5-7-17)9-15-16-14(10-19-15)8-12(3)18/h10-11,13H,4-9H2,1-3H3.
What are the key properties of 1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one?
1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one has a molecular weight of 264.37 g/mol, XLogP of 2.47, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazol-4-yl]propan-2-one is sourced from PubChem (CID 115082483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).