morpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol

C24H26F3N5O2 — CID 68723770

IUPACmorpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol
SMILESC1COCCN1.OCCCNc1nc2cc(C(F)(F)F)ccc2n2c(-c3ccccc3)cnc12
InChIInChI=1S/C20H17F3N4O.C4H9NO/c21-20(22,23)14-7-8-16-15(11-14)26-18(24-9-4-10-28)19-25-12-17(27(16)19)13-5-2-1-3-6-13;1-3-6-4-2-5-1/h1-3,5-8,11-12,28H,4,9-10H2,(H,24,26);5H,1-4H2
InChIKeyUWXFWGZYDROVJG-UHFFFAOYSA-N
MW473.50 g/mol
LogP3.97
Rot. Bonds5

About morpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol

morpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol (PubChem CID 68723770) has the molecular formula C24H26F3N5O2 and a molecular weight of 473.50 g/mol. Its IUPAC name is morpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol.

Molecular Properties

Compound Namemorpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol
PubChem CID68723770
Molecular FormulaC24H26F3N5O2
Molecular Weight473.50 g/mol
Exact Mass473.20
IUPAC Namemorpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol
SMILESC1COCCN1.OCCCNc1nc2cc(C(F)(F)F)ccc2n2c(-c3ccccc3)cnc12
InChIInChI=1S/C20H17F3N4O.C4H9NO/c21-20(22,23)14-7-8-16-15(11-14)26-18(24-9-4-10-28)19-25-12-17(27(16)19)13-5-2-1-3-6-13;1-3-6-4-2-5-1/h1-3,5-8,11-12,28H,4,9-10H2,(H,24,26);5H,1-4H2
InChIKeyUWXFWGZYDROVJG-UHFFFAOYSA-N
XLogP3.97
TPSA83.71 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500473.50
LogP ≤ 53.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze morpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol 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 morpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol?
The IUPAC name of morpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol (CID 68723770) is morpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol.
What is the SMILES notation for morpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol?
The canonical SMILES for morpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol is C1COCCN1.OCCCNc1nc2cc(C(F)(F)F)ccc2n2c(-c3ccccc3)cnc12.
What is the InChIKey of morpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol?
The InChIKey is UWXFWGZYDROVJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F3N4O.C4H9NO/c21-20(22,23)14-7-8-16-15(11-14)26-18(24-9-4-10-28)19-25-12-17(27(16)19)13-5-2-1-3-6-13;1-3-6-4-2-5-1/h1-3,5-8,11-12,28H,4,9-10H2,(H,24,26);5H,1-4H2.
What are the key properties of morpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol?
morpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol has a molecular weight of 473.50 g/mol, XLogP of 3.97, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for morpholine;3-[[1-phenyl-7-(trifluoromethyl)imidazo[1,2-a]quinoxalin-4-yl]amino]propan-1-ol is sourced from PubChem (CID 68723770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).