(2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine

C26H20F2N4O2 — CID 67382799

IUPAC(2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine
SMILESN[C@H]1CNCC2(O1)c1cc(-c3ccnc(F)c3)ccc1Oc1ccc(-c3cccnc3F)cc12
InChIInChI=1S/C26H20F2N4O2/c27-23-12-16(7-9-31-23)15-3-5-21-19(10-15)26(14-30-13-24(29)34-26)20-11-17(4-6-22(20)33-21)18-2-1-8-32-25(18)28/h1-12,24,30H,13-14,29H2/t24-,26?/m1/s1
InChIKeyVFZOZEPZFOGTPU-RMVMEJTISA-N
MW458.47 g/mol
LogP4.34
Rot. Bonds2

About (2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine

(2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine (PubChem CID 67382799) has the molecular formula C26H20F2N4O2 and a molecular weight of 458.47 g/mol. Its IUPAC name is (2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine.

Molecular Properties

Compound Name(2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine
PubChem CID67382799
Molecular FormulaC26H20F2N4O2
Molecular Weight458.47 g/mol
Exact Mass458.16
IUPAC Name(2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine
SMILESN[C@H]1CNCC2(O1)c1cc(-c3ccnc(F)c3)ccc1Oc1ccc(-c3cccnc3F)cc12
InChIInChI=1S/C26H20F2N4O2/c27-23-12-16(7-9-31-23)15-3-5-21-19(10-15)26(14-30-13-24(29)34-26)20-11-17(4-6-22(20)33-21)18-2-1-8-32-25(18)28/h1-12,24,30H,13-14,29H2/t24-,26?/m1/s1
InChIKeyVFZOZEPZFOGTPU-RMVMEJTISA-N
XLogP4.34
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500458.47
LogP ≤ 54.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze (2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine with MolForge

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Related Compounds

(4S)-4'-fluoro-7'-(2-fluoro-3-pyridinyl)-2'-(2-fluoro-4-pyridinyl)spiro[5H-1,3-oxazole-4,9'-xanthene]
CID 67383215
(5R)-1-fluoro-7-(2-fluoro-3-pyridinyl)-3-(2-fluoro-4-pyridinyl)spiro[chromeno[2,3-c]pyridine-5,3'-isoindole]-1'-amine
CID 56653077
(5R)-3-[2-fluoro-6-(2-fluoro-4-pyridinyl)-3-pyridinyl]-7-(2-fluoro-3-pyridinyl)spiro[chromeno[2,3-c]pyridine-5,3'-pyrrolo[3,4-c]pyridine]-1'-amine
CID 56654138
2-amino-1'-fluoro-7'-(2-fluoro-3-pyridinyl)-3'-(2-fluoro-4-pyridinyl)-3-methylspiro[5H-pyrimidine-6,5'-chromeno[2,3-c]pyridine]-4-one
CID 67617376
(6S)-3'-(4,4-difluoropiperidin-1-yl)-7'-(2-fluoro-3-pyridinyl)spiro[2,3-dihydro-1,4-oxazine-6,5'-chromeno[2,3-c]pyridine]-2-amine
CID 67382987
(4S)-3'-chloro-7'-(2-fluoro-3-pyridinyl)spiro[5H-1,3-oxazole-4,5'-chromeno[2,3-c]pyridine]-2-amine
CID 86640739
(5S)-3-(3,6-dihydro-2H-pyran-4-yl)-7-(2-fluoro-3-pyridinyl)spiro[chromeno[2,3-c]pyridine-5,5'-pyrrole]-2'-amine
CID 141352076
(6S)-7'-(2,5-difluorophenyl)-3'-(2-fluoro-4-pyridinyl)spiro[2,3-dihydro-1,4-oxazine-6,5'-chromeno[2,3-b]pyridine]-2-amine
CID 67382910
7'-(2-fluoro-3-pyridinyl)-3'-(oxan-4-yl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine
CID 67383033
(4S)-7'-(2-fluoro-3-pyridinyl)-3'-pyrimidin-2-ylspiro[5H-1,3-thiazole-4,5'-chromeno[2,3-b]pyridine]-2-amine
CID 58466117
3-chloro-7-(2-fluoro-3-pyridinyl)spiro[chromeno[2,3-c]pyridine-5,4'-pyrido[2,3-e][1,3]oxazine]-2'-amine
CID 56654479
3-(dimethylamino)-7-(2-fluoro-3-pyridinyl)-5-methylchromeno[2,3-c]pyridin-5-ol
CID 67383486

Frequently Asked Questions

What is the IUPAC name of (2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine?
The IUPAC name of (2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine (CID 67382799) is (2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine.
What is the SMILES notation for (2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine?
The canonical SMILES for (2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine is N[C@H]1CNCC2(O1)c1cc(-c3ccnc(F)c3)ccc1Oc1ccc(-c3cccnc3F)cc12.
What is the InChIKey of (2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine?
The InChIKey is VFZOZEPZFOGTPU-RMVMEJTISA-N. The full InChI is InChI=1S/C26H20F2N4O2/c27-23-12-16(7-9-31-23)15-3-5-21-19(10-15)26(14-30-13-24(29)34-26)20-11-17(4-6-22(20)33-21)18-2-1-8-32-25(18)28/h1-12,24,30H,13-14,29H2/t24-,26?/m1/s1.
What are the key properties of (2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine?
(2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine has a molecular weight of 458.47 g/mol, XLogP of 4.34, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2'-(2-fluoro-3-pyridinyl)-7'-(2-fluoro-4-pyridinyl)spiro[morpholine-6,9'-xanthene]-2-amine is sourced from PubChem (CID 67382799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).