[5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol

C11H18N2O2 — CID 115093485

IUPAC[5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol
SMILESCC(C)N1CCCC1c1oncc1CO
InChIInChI=1S/C11H18N2O2/c1-8(2)13-5-3-4-10(13)11-9(7-14)6-12-15-11/h6,8,10,14H,3-5,7H2,1-2H3
InChIKeyLGYMVARBXDWNGJ-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.71
Rot. Bonds3

About [5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol

[5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol (PubChem CID 115093485) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is [5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol.

Molecular Properties

Compound Name[5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol
PubChem CID115093485
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name[5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol
SMILESCC(C)N1CCCC1c1oncc1CO
InChIInChI=1S/C11H18N2O2/c1-8(2)13-5-3-4-10(13)11-9(7-14)6-12-15-11/h6,8,10,14H,3-5,7H2,1-2H3
InChIKeyLGYMVARBXDWNGJ-UHFFFAOYSA-N
XLogP1.71
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol?
The IUPAC name of [5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol (CID 115093485) is [5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol.
What is the SMILES notation for [5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol?
The canonical SMILES for [5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol is CC(C)N1CCCC1c1oncc1CO.
What is the InChIKey of [5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol?
The InChIKey is LGYMVARBXDWNGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-8(2)13-5-3-4-10(13)11-9(7-14)6-12-15-11/h6,8,10,14H,3-5,7H2,1-2H3.
What are the key properties of [5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol?
[5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol has a molecular weight of 210.28 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1-propan-2-ylpyrrolidin-2-yl)-1,2-oxazol-4-yl]methanol is sourced from PubChem (CID 115093485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).