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

C8H15NO — CID 94398019

IUPAC(3S)-3-[(3R)-oxolan-3-yl]pyrrolidine
SMILESC1C[C@@H]([C@H]2CCOC2)CN1
InChIInChI=1S/C8H15NO/c1-3-9-5-7(1)8-2-4-10-6-8/h7-9H,1-6H2/t7-,8+/m1/s1
InChIKeyUCAOFWPBPHGGOR-SFYZADRCSA-N
MW141.21 g/mol
LogP0.63
Rot. Bonds1

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

(3S)-3-[(3R)-oxolan-3-yl]pyrrolidine (PubChem CID 94398019) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (3S)-3-[(3R)-oxolan-3-yl]pyrrolidine.

Molecular Properties

Compound Name(3S)-3-[(3R)-oxolan-3-yl]pyrrolidine
PubChem CID94398019
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(3S)-3-[(3R)-oxolan-3-yl]pyrrolidine
SMILESC1C[C@@H]([C@H]2CCOC2)CN1
InChIInChI=1S/C8H15NO/c1-3-9-5-7(1)8-2-4-10-6-8/h7-9H,1-6H2/t7-,8+/m1/s1
InChIKeyUCAOFWPBPHGGOR-SFYZADRCSA-N
XLogP0.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,2,3,4,4a,5,6,7,8,8a-decahydro-2,6-naphthyridine
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3,3a,4,5,6,7,8,8a-octahydro-1H-furo[3,4-d]azepine
CID 83669058
3-cyclopropylpyrrolidine;hydrochloride
CID 162517794
3-(5-oxaspiro[3.5]nonan-8-yl)pyrrolidine
CID 104680489
4-pyrrolidin-3-yloxolan-3-ol
CID 130503492
(5aS,9aS)-1-methyl-3,5,5a,6,7,8,9,9a-octahydro-2H-pyrido[4,3-e][1,4]oxazepine
CID 129493577
1-methyl-3,5,5a,6,7,8,9,9a-octahydro-2H-pyrido[3,4-e][1,4]oxazepine
CID 130886927
oxolan-3-yl(pyrrolidin-3-yl)methanone
CID 116568253
2,3,4,4a,5,6,7,7a-octahydro-1H-cyclopenta[c]pyridine;hydrochloride
CID 131638052
(4aR,9aR)-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-cyclohepta[c]pyridine
CID 92720083
bis(1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline);silane
CID 158507793
(4aS,10aR)-1,2,3,4,4a,5,6,7,8,9,10,10a-dodecahydrocycloocta[c]pyridine
CID 164752917

Frequently Asked Questions

What is the IUPAC name of (3S)-3-[(3R)-oxolan-3-yl]pyrrolidine?
The IUPAC name of (3S)-3-[(3R)-oxolan-3-yl]pyrrolidine (CID 94398019) is (3S)-3-[(3R)-oxolan-3-yl]pyrrolidine.
What is the SMILES notation for (3S)-3-[(3R)-oxolan-3-yl]pyrrolidine?
The canonical SMILES for (3S)-3-[(3R)-oxolan-3-yl]pyrrolidine is C1C[C@@H]([C@H]2CCOC2)CN1.
What is the InChIKey of (3S)-3-[(3R)-oxolan-3-yl]pyrrolidine?
The InChIKey is UCAOFWPBPHGGOR-SFYZADRCSA-N. The full InChI is InChI=1S/C8H15NO/c1-3-9-5-7(1)8-2-4-10-6-8/h7-9H,1-6H2/t7-,8+/m1/s1.
What are the key properties of (3S)-3-[(3R)-oxolan-3-yl]pyrrolidine?
(3S)-3-[(3R)-oxolan-3-yl]pyrrolidine has a molecular weight of 141.21 g/mol, XLogP of 0.63, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-[(3R)-oxolan-3-yl]pyrrolidine is sourced from PubChem (CID 94398019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).