3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol

C7H14N2O2 — CID 146665458

IUPAC3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol
SMILESOC1OCCN1[C@H]1CCNC1
InChIInChI=1S/C7H14N2O2/c10-7-9(3-4-11-7)6-1-2-8-5-6/h6-8,10H,1-5H2/t6-,7?/m0/s1
InChIKeyLZIQJJHDRXHBJA-PKPIPKONSA-N
MW158.20 g/mol
LogP-1.04
Rot. Bonds1

About 3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol

3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol (PubChem CID 146665458) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol.

Molecular Properties

Compound Name3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol
PubChem CID146665458
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol
SMILESOC1OCCN1[C@H]1CCNC1
InChIInChI=1S/C7H14N2O2/c10-7-9(3-4-11-7)6-1-2-8-5-6/h6-8,10H,1-5H2/t6-,7?/m0/s1
InChIKeyLZIQJJHDRXHBJA-PKPIPKONSA-N
XLogP-1.04
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-1.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol?
The IUPAC name of 3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol (CID 146665458) is 3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol.
What is the SMILES notation for 3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol?
The canonical SMILES for 3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol is OC1OCCN1[C@H]1CCNC1.
What is the InChIKey of 3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol?
The InChIKey is LZIQJJHDRXHBJA-PKPIPKONSA-N. The full InChI is InChI=1S/C7H14N2O2/c10-7-9(3-4-11-7)6-1-2-8-5-6/h6-8,10H,1-5H2/t6-,7?/m0/s1.
What are the key properties of 3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol?
3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol has a molecular weight of 158.20 g/mol, XLogP of -1.04, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3S)-pyrrolidin-3-yl]-1,3-oxazolidin-2-ol is sourced from PubChem (CID 146665458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).