oxadiazole;pyrrolidine-3-carboxylic acid

C7H11N3O3 — CID 162054927

IUPACoxadiazole;pyrrolidine-3-carboxylic acid
SMILESO=C(O)C1CCNC1.c1conn1
InChIInChI=1S/C5H9NO2.C2H2N2O/c7-5(8)4-1-2-6-3-4;1-2-5-4-3-1/h4,6H,1-3H2,(H,7,8);1-2H
InChIKeyYZAXHUVVCRUBDY-UHFFFAOYSA-N
MW185.18 g/mol
LogP-0.25
Rot. Bonds1

About oxadiazole;pyrrolidine-3-carboxylic acid

oxadiazole;pyrrolidine-3-carboxylic acid (PubChem CID 162054927) has the molecular formula C7H11N3O3 and a molecular weight of 185.18 g/mol. Its IUPAC name is oxadiazole;pyrrolidine-3-carboxylic acid.

Molecular Properties

Compound Nameoxadiazole;pyrrolidine-3-carboxylic acid
PubChem CID162054927
Molecular FormulaC7H11N3O3
Molecular Weight185.18 g/mol
Exact Mass185.08
IUPAC Nameoxadiazole;pyrrolidine-3-carboxylic acid
SMILESO=C(O)C1CCNC1.c1conn1
InChIInChI=1S/C5H9NO2.C2H2N2O/c7-5(8)4-1-2-6-3-4;1-2-5-4-3-1/h4,6H,1-3H2,(H,7,8);1-2H
InChIKeyYZAXHUVVCRUBDY-UHFFFAOYSA-N
XLogP-0.25
TPSA88.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.18
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze oxadiazole;pyrrolidine-3-carboxylic acid with MolForge

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

Launch Full Analysis

Related Compounds

oxadiazole;piperidine-3-carboxylic acid
CID 157377265
oxadiazole;(2S)-pyrrolidine-2-carbaldehyde
CID 126698192
piperidine-3-carboxylic acid;(3R)-piperidine-3-carboxylic acid;pyrazine-2-carboxylic acid
CID 159112921
furan-3-yl(pyrrolidin-3-yl)methanone
CID 116568441
pyridin-4-yl(pyrrolidin-3-yl)methanone;dihydrochloride
CID 91623851
(4S)-azepane-4-carboxylic acid
CID 59261053
phenyl-[(3R)-pyrrolidin-3-yl]methanone
CID 86327261
(2-methylpyrazol-3-yl)-pyrrolidin-3-ylmethanone
CID 116568222
(3R)-N-(2-methylpyrazol-3-yl)pyrrolidine-3-carboxamide;hydrochloride
CID 130748052
(3R)-N-[2-(azetidin-3-yl)pyrazol-3-yl]pyrrolidine-3-carboxamide
CID 165482654
1,4,8,11-tetrazacyclotetradecane-6-carboxylic acid;tetrahydrochloride
CID 172994714
4-hydroxypiperidine-3-carboxylic acid
CID 10261211

Frequently Asked Questions

What is the IUPAC name of oxadiazole;pyrrolidine-3-carboxylic acid?
The IUPAC name of oxadiazole;pyrrolidine-3-carboxylic acid (CID 162054927) is oxadiazole;pyrrolidine-3-carboxylic acid.
What is the SMILES notation for oxadiazole;pyrrolidine-3-carboxylic acid?
The canonical SMILES for oxadiazole;pyrrolidine-3-carboxylic acid is O=C(O)C1CCNC1.c1conn1.
What is the InChIKey of oxadiazole;pyrrolidine-3-carboxylic acid?
The InChIKey is YZAXHUVVCRUBDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO2.C2H2N2O/c7-5(8)4-1-2-6-3-4;1-2-5-4-3-1/h4,6H,1-3H2,(H,7,8);1-2H.
What are the key properties of oxadiazole;pyrrolidine-3-carboxylic acid?
oxadiazole;pyrrolidine-3-carboxylic acid has a molecular weight of 185.18 g/mol, XLogP of -0.25, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for oxadiazole;pyrrolidine-3-carboxylic acid is sourced from PubChem (CID 162054927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).