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

C11H18N2O3 — CID 66189969

IUPAC1-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-ol
SMILESCOCc1cc(CN2CCC(O)CC2)no1
InChIInChI=1S/C11H18N2O3/c1-15-8-11-6-9(12-16-11)7-13-4-2-10(14)3-5-13/h6,10,14H,2-5,7-8H2,1H3
InChIKeyDMSRBXFOOCREEG-UHFFFAOYSA-N
MW226.28 g/mol
LogP0.78
Rot. Bonds4

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

1-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-ol (PubChem CID 66189969) has the molecular formula C11H18N2O3 and a molecular weight of 226.28 g/mol. Its IUPAC name is 1-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-ol
PubChem CID66189969
Molecular FormulaC11H18N2O3
Molecular Weight226.28 g/mol
Exact Mass226.13
IUPAC Name1-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-ol
SMILESCOCc1cc(CN2CCC(O)CC2)no1
InChIInChI=1S/C11H18N2O3/c1-15-8-11-6-9(12-16-11)7-13-4-2-10(14)3-5-13/h6,10,14H,2-5,7-8H2,1H3
InChIKeyDMSRBXFOOCREEG-UHFFFAOYSA-N
XLogP0.78
TPSA58.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-ol?
The IUPAC name of 1-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-ol (CID 66189969) is 1-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-ol.
What is the SMILES notation for 1-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-ol?
The canonical SMILES for 1-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-ol is COCc1cc(CN2CCC(O)CC2)no1.
What is the InChIKey of 1-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-ol?
The InChIKey is DMSRBXFOOCREEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3/c1-15-8-11-6-9(12-16-11)7-13-4-2-10(14)3-5-13/h6,10,14H,2-5,7-8H2,1H3.
What are the key properties of 1-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-ol?
1-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-ol has a molecular weight of 226.28 g/mol, XLogP of 0.78, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-ol is sourced from PubChem (CID 66189969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).