1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol

C12H18N2O2 — CID 171323981

IUPAC1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol
SMILESOC1CCN(Cc2cc(C3CC3)on2)CC1
InChIInChI=1S/C12H18N2O2/c15-11-3-5-14(6-4-11)8-10-7-12(16-13-10)9-1-2-9/h7,9,11,15H,1-6,8H2
InChIKeyHKWSWOARAHPQCW-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.51
Rot. Bonds3

About 1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol

1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol (PubChem CID 171323981) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol
PubChem CID171323981
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol
SMILESOC1CCN(Cc2cc(C3CC3)on2)CC1
InChIInChI=1S/C12H18N2O2/c15-11-3-5-14(6-4-11)8-10-7-12(16-13-10)9-1-2-9/h7,9,11,15H,1-6,8H2
InChIKeyHKWSWOARAHPQCW-UHFFFAOYSA-N
XLogP1.51
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol?
The IUPAC name of 1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol (CID 171323981) is 1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol.
What is the SMILES notation for 1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol?
The canonical SMILES for 1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol is OC1CCN(Cc2cc(C3CC3)on2)CC1.
What is the InChIKey of 1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol?
The InChIKey is HKWSWOARAHPQCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c15-11-3-5-14(6-4-11)8-10-7-12(16-13-10)9-1-2-9/h7,9,11,15H,1-6,8H2.
What are the key properties of 1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol?
1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol has a molecular weight of 222.29 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-cyclopropyl-1,2-oxazol-3-yl)methyl]piperidin-4-ol is sourced from PubChem (CID 171323981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).