8-(oxetan-3-yl)quinoxalin-5-amine

C11H11N3O — CID 172992565

IUPAC8-(oxetan-3-yl)quinoxalin-5-amine
SMILESNc1ccc(C2COC2)c2nccnc12
InChIInChI=1S/C11H11N3O/c12-9-2-1-8(7-5-15-6-7)10-11(9)14-4-3-13-10/h1-4,7H,5-6,12H2
InChIKeyZNDBBXDAASTRAE-UHFFFAOYSA-N
MW201.23 g/mol
LogP1.33
Rot. Bonds1

About 8-(oxetan-3-yl)quinoxalin-5-amine

8-(oxetan-3-yl)quinoxalin-5-amine (PubChem CID 172992565) has the molecular formula C11H11N3O and a molecular weight of 201.23 g/mol. Its IUPAC name is 8-(oxetan-3-yl)quinoxalin-5-amine.

Molecular Properties

Compound Name8-(oxetan-3-yl)quinoxalin-5-amine
PubChem CID172992565
Molecular FormulaC11H11N3O
Molecular Weight201.23 g/mol
Exact Mass201.09
IUPAC Name8-(oxetan-3-yl)quinoxalin-5-amine
SMILESNc1ccc(C2COC2)c2nccnc12
InChIInChI=1S/C11H11N3O/c12-9-2-1-8(7-5-15-6-7)10-11(9)14-4-3-13-10/h1-4,7H,5-6,12H2
InChIKeyZNDBBXDAASTRAE-UHFFFAOYSA-N
XLogP1.33
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-bromo-8-cyclopropylquinoxaline
CID 172993584
2-(oxetan-3-yl)pyridin-4-amine
CID 155204182
4-(oxolan-3-yloxy)quinolin-8-amine
CID 83061222
4-N-cyclopropylquinoline-4,8-diamine
CID 83059537
4-N-(oxan-3-yl)quinoline-4,8-diamine
CID 83060374
5-(oxetan-3-yl)pyridin-2-amine
CID 154705983
2-(oxolan-3-yl)pyridine-3,4-diamine
CID 129239595
5-cyclopropyl-3-(oxetan-3-yl)pyridin-2-amine
CID 153343805
4-(oxolan-3-yl)-1H-benzimidazole
CID 59279276
3-(oxetan-3-yl)pyrazine-2-carboxamide
CID 166006008
8-cyclopropylquinoline
CID 66823369
5-N-morpholin-4-ylquinoline-5,8-diamine
CID 83004132

Frequently Asked Questions

What is the IUPAC name of 8-(oxetan-3-yl)quinoxalin-5-amine?
The IUPAC name of 8-(oxetan-3-yl)quinoxalin-5-amine (CID 172992565) is 8-(oxetan-3-yl)quinoxalin-5-amine.
What is the SMILES notation for 8-(oxetan-3-yl)quinoxalin-5-amine?
The canonical SMILES for 8-(oxetan-3-yl)quinoxalin-5-amine is Nc1ccc(C2COC2)c2nccnc12.
What is the InChIKey of 8-(oxetan-3-yl)quinoxalin-5-amine?
The InChIKey is ZNDBBXDAASTRAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c12-9-2-1-8(7-5-15-6-7)10-11(9)14-4-3-13-10/h1-4,7H,5-6,12H2.
What are the key properties of 8-(oxetan-3-yl)quinoxalin-5-amine?
8-(oxetan-3-yl)quinoxalin-5-amine has a molecular weight of 201.23 g/mol, XLogP of 1.33, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(oxetan-3-yl)quinoxalin-5-amine is sourced from PubChem (CID 172992565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).