(4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine

C15H19FN2O — CID 105366461

IUPAC(4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine
SMILESN[C@@H]1CC2(CCN3CCC2C3)Oc2cc(F)ccc21
InChIInChI=1S/C15H19FN2O/c16-11-1-2-12-13(17)8-15(19-14(12)7-11)4-6-18-5-3-10(15)9-18/h1-2,7,10,13H,3-6,8-9,17H2/t10?,13-,15?/m1/s1
InChIKeyOBFPMEOINACLFA-VROQLPPWSA-N
MW262.33 g/mol
LogP2.07
Rot. Bonds

About (4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine

(4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine (PubChem CID 105366461) has the molecular formula C15H19FN2O and a molecular weight of 262.33 g/mol. Its IUPAC name is (4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine.

Molecular Properties

Compound Name(4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine
PubChem CID105366461
Molecular FormulaC15H19FN2O
Molecular Weight262.33 g/mol
Exact Mass262.15
IUPAC Name(4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine
SMILESN[C@@H]1CC2(CCN3CCC2C3)Oc2cc(F)ccc21
InChIInChI=1S/C15H19FN2O/c16-11-1-2-12-13(17)8-15(19-14(12)7-11)4-6-18-5-3-10(15)9-18/h1-2,7,10,13H,3-6,8-9,17H2/t10?,13-,15?/m1/s1
InChIKeyOBFPMEOINACLFA-VROQLPPWSA-N
XLogP2.07
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine with MolForge

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Related Compounds

(4'R)-6'-methoxyspiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine
CID 105366453
7-fluoro-1',1'-dimethylspiro[3,4-dihydrochromene-2,4'-cyclohexane]-4-amine
CID 114710216
(4S)-7-fluoro-1'-propan-2-ylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
CID 104947683
7-fluorospiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
CID 82389200
(4S)-7-fluoro-1'-propan-2-ylspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-amine
CID 104947698
(4S)-7-fluoro-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
CID 104947626
(4R)-3'-ethyl-7-fluorospiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 104948009
(4R)-1'-ethyl-7-fluorospiro[3,4-dihydrochromene-2,4'-azepane]-4-amine
CID 104947934
7-fluoro-2',6'-dimethylspiro[3,4-dihydrochromene-2,4'-oxane]-4-amine
CID 114710301
(4R)-7-fluoro-3'-methoxyspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 106875207
(4R)-7-fluoro-2-methyl-2-pentyl-3,4-dihydrochromen-4-amine
CID 104947950
(4S)-6-fluoro-2',3'-dimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 104944135

Frequently Asked Questions

What is the IUPAC name of (4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine?
The IUPAC name of (4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine (CID 105366461) is (4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine.
What is the SMILES notation for (4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine?
The canonical SMILES for (4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine is N[C@@H]1CC2(CCN3CCC2C3)Oc2cc(F)ccc21.
What is the InChIKey of (4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine?
The InChIKey is OBFPMEOINACLFA-VROQLPPWSA-N. The full InChI is InChI=1S/C15H19FN2O/c16-11-1-2-12-13(17)8-15(19-14(12)7-11)4-6-18-5-3-10(15)9-18/h1-2,7,10,13H,3-6,8-9,17H2/t10?,13-,15?/m1/s1.
What are the key properties of (4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine?
(4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine has a molecular weight of 262.33 g/mol, XLogP of 2.07, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4'R)-7'-fluorospiro[1-azabicyclo[3.2.1]octane-4,2'-3,4-dihydrochromene]-4'-amine is sourced from PubChem (CID 105366461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).