[(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol

C8H13N3O2 — CID 62733850

IUPAC[(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol
SMILESOC[C@H]1CCCN1Cc1ncno1
InChIInChI=1S/C8H13N3O2/c12-5-7-2-1-3-11(7)4-8-9-6-10-13-8/h6-7,12H,1-5H2/t7-/m1/s1
InChIKeyOTSDBCFJQBPWHX-SSDOTTSWSA-N
MW183.21 g/mol
LogP0.03
Rot. Bonds3

About [(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol

[(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol (PubChem CID 62733850) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is [(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol
PubChem CID62733850
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name[(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol
SMILESOC[C@H]1CCCN1Cc1ncno1
InChIInChI=1S/C8H13N3O2/c12-5-7-2-1-3-11(7)4-8-9-6-10-13-8/h6-7,12H,1-5H2/t7-/m1/s1
InChIKeyOTSDBCFJQBPWHX-SSDOTTSWSA-N
XLogP0.03
TPSA62.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol?
The IUPAC name of [(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol (CID 62733850) is [(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol is OC[C@H]1CCCN1Cc1ncno1.
What is the InChIKey of [(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol?
The InChIKey is OTSDBCFJQBPWHX-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H13N3O2/c12-5-7-2-1-3-11(7)4-8-9-6-10-13-8/h6-7,12H,1-5H2/t7-/m1/s1.
What are the key properties of [(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol?
[(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol has a molecular weight of 183.21 g/mol, XLogP of 0.03, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 62733850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).