(2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol

C7H15NO3 — CID 141146160

IUPAC(2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol
SMILESOC[C@@H](O)CO[C@@H]1CCNC1
InChIInChI=1S/C7H15NO3/c9-4-6(10)5-11-7-1-2-8-3-7/h6-10H,1-5H2/t6-,7-/m1/s1
InChIKeyPXHHOROKWYTDFU-RNFRBKRXSA-N
MW161.20 g/mol
LogP-1.28
Rot. Bonds4

About (2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol

(2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol (PubChem CID 141146160) has the molecular formula C7H15NO3 and a molecular weight of 161.20 g/mol. Its IUPAC name is (2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol.

Molecular Properties

Compound Name(2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol
PubChem CID141146160
Molecular FormulaC7H15NO3
Molecular Weight161.20 g/mol
Exact Mass161.11
IUPAC Name(2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol
SMILESOC[C@@H](O)CO[C@@H]1CCNC1
InChIInChI=1S/C7H15NO3/c9-4-6(10)5-11-7-1-2-8-3-7/h6-10H,1-5H2/t6-,7-/m1/s1
InChIKeyPXHHOROKWYTDFU-RNFRBKRXSA-N
XLogP-1.28
TPSA61.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 5-1.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-(pyrrolidin-3-ylmethoxy)propane-1,2-diol
CID 106938106
3-(4-hydroxycyclohexyl)oxypropane-1,2-diol
CID 21393261
1-[(3S)-piperidin-3-yl]oxy-3-propan-2-yloxypropan-2-ol
CID 106940494
3-(2-chloroprop-2-enoxy)pyrrolidine
CID 62328785
3-ethoxypyrrolidine
CID 21333172
(3S)-3-ethoxypyrrolidine
CID 11116030
1-(1-methoxypropan-2-yloxy)-3-piperidin-4-yloxypropan-2-ol
CID 106991198
ethane;3-ethoxypyrrolidine
CID 142624915
3-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropane-1,2-diol
CID 142047447
2-[(3S)-pyrrolidin-3-yl]oxyacetamide
CID 94401198
(3S)-3-prop-2-enoxypyrrolidine
CID 26191822
2,2-dimethylpropanoic acid;(3R)-3-ethoxypyrrolidine
CID 174626759

Frequently Asked Questions

What is the IUPAC name of (2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol?
The IUPAC name of (2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol (CID 141146160) is (2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol.
What is the SMILES notation for (2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol?
The canonical SMILES for (2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol is OC[C@@H](O)CO[C@@H]1CCNC1.
What is the InChIKey of (2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol?
The InChIKey is PXHHOROKWYTDFU-RNFRBKRXSA-N. The full InChI is InChI=1S/C7H15NO3/c9-4-6(10)5-11-7-1-2-8-3-7/h6-10H,1-5H2/t6-,7-/m1/s1.
What are the key properties of (2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol?
(2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol has a molecular weight of 161.20 g/mol, XLogP of -1.28, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-[(3R)-pyrrolidin-3-yl]oxypropane-1,2-diol is sourced from PubChem (CID 141146160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).