4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine

C21H23N3O2 — CID 51039662

IUPAC4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine
SMILESCC(C)Oc1cccc(-c2ccc3ncc(N4CCOCC4)nc3c2)c1
InChIInChI=1S/C21H23N3O2/c1-15(2)26-18-5-3-4-16(12-18)17-6-7-19-20(13-17)23-21(14-22-19)24-8-10-25-11-9-24/h3-7,12-15H,8-11H2,1-2H3
InChIKeySLIPODJIDDVAGC-UHFFFAOYSA-N
MW349.43 g/mol
LogP3.92
Rot. Bonds4

About 4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine

4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine (PubChem CID 51039662) has the molecular formula C21H23N3O2 and a molecular weight of 349.43 g/mol. Its IUPAC name is 4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine.

Molecular Properties

Compound Name4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine
PubChem CID51039662
Molecular FormulaC21H23N3O2
Molecular Weight349.43 g/mol
Exact Mass349.18
IUPAC Name4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine
SMILESCC(C)Oc1cccc(-c2ccc3ncc(N4CCOCC4)nc3c2)c1
InChIInChI=1S/C21H23N3O2/c1-15(2)26-18-5-3-4-16(12-18)17-6-7-19-20(13-17)23-21(14-22-19)24-8-10-25-11-9-24/h3-7,12-15H,8-11H2,1-2H3
InChIKeySLIPODJIDDVAGC-UHFFFAOYSA-N
XLogP3.92
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine?
The IUPAC name of 4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine (CID 51039662) is 4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine.
What is the SMILES notation for 4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine?
The canonical SMILES for 4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine is CC(C)Oc1cccc(-c2ccc3ncc(N4CCOCC4)nc3c2)c1.
What is the InChIKey of 4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine?
The InChIKey is SLIPODJIDDVAGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O2/c1-15(2)26-18-5-3-4-16(12-18)17-6-7-19-20(13-17)23-21(14-22-19)24-8-10-25-11-9-24/h3-7,12-15H,8-11H2,1-2H3.
What are the key properties of 4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine?
4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine has a molecular weight of 349.43 g/mol, XLogP of 3.92, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[7-(3-propan-2-yloxyphenyl)quinoxalin-2-yl]morpholine is sourced from PubChem (CID 51039662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).