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

C8H13N3O2 — CID 62013760

IUPAC[1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1Cc1ncno1
InChIInChI=1S/C8H13N3O2/c12-5-7-2-1-3-11(7)4-8-9-6-10-13-8/h6-7,12H,1-5H2
InChIKeyOTSDBCFJQBPWHX-UHFFFAOYSA-N
MW183.21 g/mol
LogP0.03
Rot. Bonds3

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

[1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol (PubChem CID 62013760) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is [1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol
PubChem CID62013760
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name[1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1Cc1ncno1
InChIInChI=1S/C8H13N3O2/c12-5-7-2-1-3-11(7)4-8-9-6-10-13-8/h6-7,12H,1-5H2
InChIKeyOTSDBCFJQBPWHX-UHFFFAOYSA-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

Analyze [1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol?
The IUPAC name of [1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol (CID 62013760) is [1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol?
The canonical SMILES for [1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol is OCC1CCCN1Cc1ncno1.
What is the InChIKey of [1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol?
The InChIKey is OTSDBCFJQBPWHX-UHFFFAOYSA-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.
What are the key properties of [1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol?
[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 [1-(1,2,4-oxadiazol-5-ylmethyl)pyrrolidin-2-yl]methanol is sourced from PubChem (CID 62013760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).