(3-aminooxolan-3-yl)methanol

C5H11NO2 — CID 58134851

IUPAC(3-aminooxolan-3-yl)methanol
SMILESNC1(CO)CCOC1
InChIInChI=1S/C5H11NO2/c6-5(3-7)1-2-8-4-5/h7H,1-4,6H2
InChIKeyOJPSWNKHXFWIQJ-UHFFFAOYSA-N
MW117.15 g/mol
LogP-0.90
Rot. Bonds1

About (3-aminooxolan-3-yl)methanol

(3-aminooxolan-3-yl)methanol (PubChem CID 58134851) has the molecular formula C5H11NO2 and a molecular weight of 117.15 g/mol. Its IUPAC name is (3-aminooxolan-3-yl)methanol.

Molecular Properties

Compound Name(3-aminooxolan-3-yl)methanol
PubChem CID58134851
Molecular FormulaC5H11NO2
Molecular Weight117.15 g/mol
Exact Mass117.08
IUPAC Name(3-aminooxolan-3-yl)methanol
SMILESNC1(CO)CCOC1
InChIInChI=1S/C5H11NO2/c6-5(3-7)1-2-8-4-5/h7H,1-4,6H2
InChIKeyOJPSWNKHXFWIQJ-UHFFFAOYSA-N
XLogP-0.90
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.15
LogP ≤ 5-0.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-Amino-4-methoxy-3-methylbutan-1-ol
CID 65240020
2-(3-Aminooxolan-3-yl)ethan-1-ol
CID 65240021
rac-[(3R,4R)-4-aminooxolan-3-yl]methanol
CID 105530406
2-Amino-2-(hydroxymethyl)butane-1,4-diol
CID 18435579
3-(Methoxymethyl)oxolan-3-amine hydrochloride
CID 121553131
(3-Amino-4,4-dimethyloxolan-3-yl)methanol hydrochloride
CID 178199961
((3R,4R)-4-Aminotetrahydrofuran-3-yl)methanol
CID 55284198
2-(3-Aminooxetan-3-yl)ethanol
CID 71432942
3-(Methoxymethyl)oxolan-3-amine
CID 83904842
(3-Amino-4-fluorooxolan-3-yl)methanediol
CID 123496078
[(3R,4R)-3-amino-4-fluorooxolan-3-yl]methanediol
CID 144289985
[(3S,4R)-3-amino-4-fluorooxolan-3-yl]methanol
CID 164034333

Frequently Asked Questions

What is the IUPAC name of (3-aminooxolan-3-yl)methanol?
The IUPAC name of (3-aminooxolan-3-yl)methanol (CID 58134851) is (3-aminooxolan-3-yl)methanol.
What is the SMILES notation for (3-aminooxolan-3-yl)methanol?
The canonical SMILES for (3-aminooxolan-3-yl)methanol is NC1(CO)CCOC1.
What is the InChIKey of (3-aminooxolan-3-yl)methanol?
The InChIKey is OJPSWNKHXFWIQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2/c6-5(3-7)1-2-8-4-5/h7H,1-4,6H2.
What are the key properties of (3-aminooxolan-3-yl)methanol?
(3-aminooxolan-3-yl)methanol has a molecular weight of 117.15 g/mol, XLogP of -0.90, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminooxolan-3-yl)methanol is sourced from PubChem (CID 58134851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).