(2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone

C15H17N3O2 — CID 23911652

IUPAC(2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone
SMILESCc1nc2ccc(C(=O)N3CCOCC3)cc2nc1C
InChIInChI=1S/C15H17N3O2/c1-10-11(2)17-14-9-12(3-4-13(14)16-10)15(19)18-5-7-20-8-6-18/h3-4,9H,5-8H2,1-2H3
InChIKeyODKWFLDPMUNYBS-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.72
Rot. Bonds1

About (2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone

(2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone (PubChem CID 23911652) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is (2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone
PubChem CID23911652
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name(2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone
SMILESCc1nc2ccc(C(=O)N3CCOCC3)cc2nc1C
InChIInChI=1S/C15H17N3O2/c1-10-11(2)17-14-9-12(3-4-13(14)16-10)15(19)18-5-7-20-8-6-18/h3-4,9H,5-8H2,1-2H3
InChIKeyODKWFLDPMUNYBS-UHFFFAOYSA-N
XLogP1.72
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone?
The IUPAC name of (2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone (CID 23911652) is (2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone is Cc1nc2ccc(C(=O)N3CCOCC3)cc2nc1C.
What is the InChIKey of (2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone?
The InChIKey is ODKWFLDPMUNYBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-10-11(2)17-14-9-12(3-4-13(14)16-10)15(19)18-5-7-20-8-6-18/h3-4,9H,5-8H2,1-2H3.
What are the key properties of (2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone?
(2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone has a molecular weight of 271.32 g/mol, XLogP of 1.72, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dimethylquinoxalin-6-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 23911652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).