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1254981-62-8 | Spiro[furo[2,3-b]pyridine-3(2H),4'-piperidine], 1'-(phenylmethyl)-
CAS No: 1254981-62-8 Catalog No: AG000NQX MDL No:
Product Description
Catalog Number:
AG000NQX
Chemical Name:
Spiro[furo[2,3-b]pyridine-3(2H),4'-piperidine], 1'-(phenylmethyl)-
CAS Number:
1254981-62-8
Molecular Formula:
C18H20N2O
Molecular Weight:
280.3642
IUPAC Name:
1'-benzylspiro[2H-furo[2,3-b]pyridine-3,4'-piperidine]
InChI:
InChI=1S/C18H20N2O/c1-2-5-15(6-3-1)13-20-11-8-18(9-12-20)14-21-17-16(18)7-4-10-19-17/h1-7,10H,8-9,11-14H2
InChI Key:
GCDDUUKCLOWKCS-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CN1CCC2(CC1)COc1c2cccn1
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.158g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.371g/mol
Monoisotopic Mass:
280.158g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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