2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone

C15H17N3O2 — CID 3667314

IUPAC2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone
SMILESCc1nc2ccccc2nc1CC(=O)N1CCOCC1
InChIInChI=1S/C15H17N3O2/c1-11-14(10-15(19)18-6-8-20-9-7-18)17-13-5-3-2-4-12(13)16-11/h2-5H,6-10H2,1H3
InChIKeyYLXHFZNCSATEDW-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.34
Rot. Bonds2

About 2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone

2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone (PubChem CID 3667314) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone
PubChem CID3667314
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone
SMILESCc1nc2ccccc2nc1CC(=O)N1CCOCC1
InChIInChI=1S/C15H17N3O2/c1-11-14(10-15(19)18-6-8-20-9-7-18)17-13-5-3-2-4-12(13)16-11/h2-5H,6-10H2,1H3
InChIKeyYLXHFZNCSATEDW-UHFFFAOYSA-N
XLogP1.34
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone?
The IUPAC name of 2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone (CID 3667314) is 2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone?
The canonical SMILES for 2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone is Cc1nc2ccccc2nc1CC(=O)N1CCOCC1.
What is the InChIKey of 2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone?
The InChIKey is YLXHFZNCSATEDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-11-14(10-15(19)18-6-8-20-9-7-18)17-13-5-3-2-4-12(13)16-11/h2-5H,6-10H2,1H3.
What are the key properties of 2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone?
2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone has a molecular weight of 271.32 g/mol, XLogP of 1.34, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylquinoxalin-2-yl)-1-morpholin-4-ylethanone is sourced from PubChem (CID 3667314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).