(3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine

C9H17NO2 — CID 26191909

IUPAC(3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine
SMILESC1CO[C@@H](CO[C@H]2CCNC2)C1
InChIInChI=1S/C9H17NO2/c1-2-9(11-5-1)7-12-8-3-4-10-6-8/h8-10H,1-7H2/t8-,9+/m0/s1
InChIKeyOXFDYGSXJXYMFY-DTWKUNHWSA-N
MW171.24 g/mol
LogP0.54
Rot. Bonds3

About (3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine

(3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine (PubChem CID 26191909) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is (3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine.

Molecular Properties

Compound Name(3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine
PubChem CID26191909
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name(3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine
SMILESC1CO[C@@H](CO[C@H]2CCNC2)C1
InChIInChI=1S/C9H17NO2/c1-2-9(11-5-1)7-12-8-3-4-10-6-8/h8-10H,1-7H2/t8-,9+/m0/s1
InChIKeyOXFDYGSXJXYMFY-DTWKUNHWSA-N
XLogP0.54
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(oxolan-2-ylmethoxy)piperidine;hydrochloride
CID 45074945
3-(oxolan-2-ylmethoxymethyl)pyrrolidine
CID 62372457
2-(cyclobutyloxymethyl)morpholine
CID 64533662
4-(oxolan-2-ylmethoxy)cyclohexan-1-amine
CID 62806705
3-(oxolan-2-ylmethoxy)oxane
CID 71311379
oxolan-2-ylmethyl 2-piperidin-4-yloxyacetate
CID 63869920
3-(cyclohexylmethoxy)pyrrolidine
CID 45075453
3-(cyclobutylmethoxy)pyrrolidine;hydrochloride
CID 53409349
4-methyl-2-[[(3S)-piperidin-3-yl]oxymethyl]morpholine
CID 79183215
oxolan-2-ylmethyl pyrrolidine-3-carboxylate
CID 63031488
3-[2-(oxolan-2-yl)ethyl]pyrrolidine
CID 104680566
3-(oxolan-2-ylmethoxy)cyclohexan-1-ol
CID 79618250

Frequently Asked Questions

What is the IUPAC name of (3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine?
The IUPAC name of (3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine (CID 26191909) is (3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine.
What is the SMILES notation for (3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine?
The canonical SMILES for (3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine is C1CO[C@@H](CO[C@H]2CCNC2)C1.
What is the InChIKey of (3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine?
The InChIKey is OXFDYGSXJXYMFY-DTWKUNHWSA-N. The full InChI is InChI=1S/C9H17NO2/c1-2-9(11-5-1)7-12-8-3-4-10-6-8/h8-10H,1-7H2/t8-,9+/m0/s1.
What are the key properties of (3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine?
(3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine has a molecular weight of 171.24 g/mol, XLogP of 0.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-[[(2R)-oxolan-2-yl]methoxy]pyrrolidine is sourced from PubChem (CID 26191909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).