1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol

C15H26N2O2 — CID 111106894

IUPAC1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol
SMILESCC(O)C1CCCCN1Cc1ncc(C(C)(C)C)o1
InChIInChI=1S/C15H26N2O2/c1-11(18)12-7-5-6-8-17(12)10-14-16-9-13(19-14)15(2,3)4/h9,11-12,18H,5-8,10H2,1-4H3
InChIKeyJGFYXJOKSOMSTM-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.71
Rot. Bonds3

About 1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol

1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol (PubChem CID 111106894) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol.

Molecular Properties

Compound Name1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol
PubChem CID111106894
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol
SMILESCC(O)C1CCCCN1Cc1ncc(C(C)(C)C)o1
InChIInChI=1S/C15H26N2O2/c1-11(18)12-7-5-6-8-17(12)10-14-16-9-13(19-14)15(2,3)4/h9,11-12,18H,5-8,10H2,1-4H3
InChIKeyJGFYXJOKSOMSTM-UHFFFAOYSA-N
XLogP2.71
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol?
The IUPAC name of 1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol (CID 111106894) is 1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol.
What is the SMILES notation for 1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol?
The canonical SMILES for 1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol is CC(O)C1CCCCN1Cc1ncc(C(C)(C)C)o1.
What is the InChIKey of 1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol?
The InChIKey is JGFYXJOKSOMSTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-11(18)12-7-5-6-8-17(12)10-14-16-9-13(19-14)15(2,3)4/h9,11-12,18H,5-8,10H2,1-4H3.
What are the key properties of 1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol?
1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol has a molecular weight of 266.38 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]ethanol is sourced from PubChem (CID 111106894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).