[3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol

C11H19N3O3 — CID 111976726

IUPAC[3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol
SMILESCCc1noc(CN(C)CC2(CO)COC2)n1
InChIInChI=1S/C11H19N3O3/c1-3-9-12-10(17-13-9)4-14(2)5-11(6-15)7-16-8-11/h15H,3-8H2,1-2H3
InChIKeyQYPRLSFDIABMOY-UHFFFAOYSA-N
MW241.29 g/mol
LogP0.07
Rot. Bonds6

About [3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol

[3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol (PubChem CID 111976726) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is [3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol.

Molecular Properties

Compound Name[3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol
PubChem CID111976726
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name[3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol
SMILESCCc1noc(CN(C)CC2(CO)COC2)n1
InChIInChI=1S/C11H19N3O3/c1-3-9-12-10(17-13-9)4-14(2)5-11(6-15)7-16-8-11/h15H,3-8H2,1-2H3
InChIKeyQYPRLSFDIABMOY-UHFFFAOYSA-N
XLogP0.07
TPSA71.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol with MolForge

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Related Compounds

1-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]-4-methylcyclohexan-1-ol
CID 111461808
2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]acetic acid
CID 43442230
[4-[[methyl-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]amino]methyl]oxan-4-yl]methanol
CID 91841621
[3-[[benzyl(methyl)amino]methyl]oxetan-3-yl]methanol
CID 111976476
1-cyclopropyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]ethanol
CID 111858607
2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-(2-hydroxyethyl)amino]ethanol
CID 62022852
[3-[[[2-(dimethylamino)pyrimidin-5-yl]methyl-methylamino]methyl]oxetan-3-yl]methanol
CID 110019569
2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]propanoic acid
CID 62637255
N-tert-butyl-2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]acetamide
CID 86919203
[3-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]oxetan-3-yl]methanol
CID 115249023
methyl 3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]-2-methylpropanoate
CID 60971190
N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-1-(furan-2-yl)-N-methylmethanamine
CID 51075896

Frequently Asked Questions

What is the IUPAC name of [3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol?
The IUPAC name of [3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol (CID 111976726) is [3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol.
What is the SMILES notation for [3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol?
The canonical SMILES for [3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol is CCc1noc(CN(C)CC2(CO)COC2)n1.
What is the InChIKey of [3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol?
The InChIKey is QYPRLSFDIABMOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-3-9-12-10(17-13-9)4-14(2)5-11(6-15)7-16-8-11/h15H,3-8H2,1-2H3.
What are the key properties of [3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol?
[3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol has a molecular weight of 241.29 g/mol, XLogP of 0.07, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]methyl]oxetan-3-yl]methanol is sourced from PubChem (CID 111976726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).