2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol

C9H15NO2 — CID 164654574

IUPAC2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol
SMILESOC(C1=COCC1)[C@H]1CCNC1
InChIInChI=1S/C9H15NO2/c11-9(7-1-3-10-5-7)8-2-4-12-6-8/h6-7,9-11H,1-5H2/t7-,9?/m0/s1
InChIKeyZCWDVKDZIXKGLT-JAVCKPHESA-N
MW169.22 g/mol
LogP0.26
Rot. Bonds2

About 2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol

2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol (PubChem CID 164654574) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is 2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol
PubChem CID164654574
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Name2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol
SMILESOC(C1=COCC1)[C@H]1CCNC1
InChIInChI=1S/C9H15NO2/c11-9(7-1-3-10-5-7)8-2-4-12-6-8/h6-7,9-11H,1-5H2/t7-,9?/m0/s1
InChIKeyZCWDVKDZIXKGLT-JAVCKPHESA-N
XLogP0.26
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-Dihydrofuran-4-yl(piperidin-3-yl)methanol
CID 130579054
1-(4,5-Dihydrofuran-3-yl)-2-(pyrrolidin-3-yl)ethan-1-ol
CID 164650142
1-(4,5-Dihydrofuran-3-yl)-2-(pyrrolidin-2-yl)ethan-1-ol
CID 164650220
(4,5-Dihydrofuran-3-yl)(pyrrolidin-3-yl)methanol
CID 164650225
(3,4-Dihydro-2h-pyran-5-yl)[(3s)-pyrrolidin-3-yl]methanol
CID 164654109
rac-(3R,4S)-4-(3,4-dihydro-2H-pyran-5-yl)pyrrolidin-3-ol
CID 165592975
4-(3,4-dihydro-2H-pyran-5-yl)pyrrolidin-3-ol
CID 165786572

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol?
The IUPAC name of 2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol (CID 164654574) is 2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol.
What is the SMILES notation for 2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol?
The canonical SMILES for 2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol is OC(C1=COCC1)[C@H]1CCNC1.
What is the InChIKey of 2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol?
The InChIKey is ZCWDVKDZIXKGLT-JAVCKPHESA-N. The full InChI is InChI=1S/C9H15NO2/c11-9(7-1-3-10-5-7)8-2-4-12-6-8/h6-7,9-11H,1-5H2/t7-,9?/m0/s1.
What are the key properties of 2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol?
2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol has a molecular weight of 169.22 g/mol, XLogP of 0.26, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-4-yl-[(3S)-pyrrolidin-3-yl]methanol is sourced from PubChem (CID 164654574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).