4-quinolin-2-yl-1,2,5-oxadiazol-3-amine

C11H8N4O — CID 12536668

IUPAC4-quinolin-2-yl-1,2,5-oxadiazol-3-amine
SMILESNc1nonc1-c1ccc2ccccc2n1
InChIInChI=1S/C11H8N4O/c12-11-10(14-16-15-11)9-6-5-7-3-1-2-4-8(7)13-9/h1-6H,(H2,12,15)
InChIKeyUYABAZFOUVLUHD-UHFFFAOYSA-N
MW212.21 g/mol
LogP1.87
Rot. Bonds1

About 4-quinolin-2-yl-1,2,5-oxadiazol-3-amine

4-quinolin-2-yl-1,2,5-oxadiazol-3-amine (PubChem CID 12536668) has the molecular formula C11H8N4O and a molecular weight of 212.21 g/mol. Its IUPAC name is 4-quinolin-2-yl-1,2,5-oxadiazol-3-amine.

Molecular Properties

Compound Name4-quinolin-2-yl-1,2,5-oxadiazol-3-amine
PubChem CID12536668
Molecular FormulaC11H8N4O
Molecular Weight212.21 g/mol
Exact Mass212.07
IUPAC Name4-quinolin-2-yl-1,2,5-oxadiazol-3-amine
SMILESNc1nonc1-c1ccc2ccccc2n1
InChIInChI=1S/C11H8N4O/c12-11-10(14-16-15-11)9-6-5-7-3-1-2-4-8(7)13-9/h1-6H,(H2,12,15)
InChIKeyUYABAZFOUVLUHD-UHFFFAOYSA-N
XLogP1.87
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.21
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-quinolin-2-yl-1,2,5-oxadiazol-3-amine 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

2-(4-quinolin-2-yl-1H-pyrrol-3-yl)quinoline
CID 54524072
5-quinolin-2-ylpyrimidin-2-amine
CID 112694944
4-(1H-benzo[f]benzimidazol-2-yl)-1,2,5-oxadiazol-3-amine
CID 136934863
iridium;tris(2-phenylquinoline)
CID 122129463
quinolin-2-amine;zirconium
CID 175251209
CID 158897445
CID 158897445
3-iodo-5-quinolin-2-yl-1,2,4-oxadiazole
CID 112572320
2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline
CID 18470716
8-quinolin-2-yl-7H-purin-6-amine
CID 114608266
1-amino-1-(3-quinolin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol
CID 63218930
4-quinolin-2-ylpyridin-2-amine
CID 82556017
4-quinolin-2-yloxadiazole
CID 18990797

Frequently Asked Questions

What is the IUPAC name of 4-quinolin-2-yl-1,2,5-oxadiazol-3-amine?
The IUPAC name of 4-quinolin-2-yl-1,2,5-oxadiazol-3-amine (CID 12536668) is 4-quinolin-2-yl-1,2,5-oxadiazol-3-amine.
What is the SMILES notation for 4-quinolin-2-yl-1,2,5-oxadiazol-3-amine?
The canonical SMILES for 4-quinolin-2-yl-1,2,5-oxadiazol-3-amine is Nc1nonc1-c1ccc2ccccc2n1.
What is the InChIKey of 4-quinolin-2-yl-1,2,5-oxadiazol-3-amine?
The InChIKey is UYABAZFOUVLUHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N4O/c12-11-10(14-16-15-11)9-6-5-7-3-1-2-4-8(7)13-9/h1-6H,(H2,12,15).
What are the key properties of 4-quinolin-2-yl-1,2,5-oxadiazol-3-amine?
4-quinolin-2-yl-1,2,5-oxadiazol-3-amine has a molecular weight of 212.21 g/mol, XLogP of 1.87, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-quinolin-2-yl-1,2,5-oxadiazol-3-amine is sourced from PubChem (CID 12536668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).