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Home > Other Heterocycles > 1422068-68-5
1422068-68-5 | 1-(pyrrolidin-1-yl)-2-(spiro[chroman-2,4'-piperidin]-4-yl)ethanone
CAS No: 1422068-68-5 Catalog No: AG01DJRX MDL No:
Product Description
Catalog Number:
AG01DJRX
Chemical Name:
1-(pyrrolidin-1-yl)-2-(spiro[chroman-2,4'-piperidin]-4-yl)ethanone
CAS Number:
1422068-68-5
Molecular Formula:
C19H26N2O2
Molecular Weight:
314.4219
IUPAC Name:
1-pyrrolidin-1-yl-2-spiro[3,4-dihydrochromene-2,4'-piperidine]-4-ylethanone
InChI:
InChI=1S/C19H26N2O2/c22-18(21-11-3-4-12-21)13-15-14-19(7-9-20-10-8-19)23-17-6-2-1-5-16(15)17/h1-2,5-6,15,20H,3-4,7-14H2
InChI Key:
TZTIMWWNKMTVCK-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC1)CC1CC2(CCNCC2)Oc2c1cccc2
Properties
Complexity:
427
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.199g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
314.429g/mol
Monoisotopic Mass:
314.199g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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