1'-Benzylspiro[1,2-Dihydropyrrolo[2,3-B]Pyridine-3,4'-Piperidine] - CAS 845552-76-3

Catalog:	BB055113
Product Name:	1'-Benzylspiro[1,2-Dihydropyrrolo[2,3-B]Pyridine-3,4'-Piperidine]
CAS:	845552-76-3
Synonyms:	1-Benzyl-1',2'-dihydrospiro[piperidine-4,3'-pyrrolo[2,3-b]pyridine]; Spiro[piperidine-4,3'-[3H]pyrrolo[2,3-b]pyridine],1',2'-dihydro-1-(phenylmethyl)-; Spiro[piperidine-4,3'-[3H]pyrrolo[2,3-b]pyridine], 1',2'-dihydro-1-(phenylmethyl)-; 1'-benzylspiro[1,2-dihydropyrrolo[2,3-b]pyridine-3,4'-piperidine]; 1-Benzyl-1,2-Dihydrospiro[Piperidine-4,3-Pyrrolo[2,3-B]Pyridine]

Technical Data

IUPAC Name:	1'-benzylspiro[1,2-dihydropyrrolo[2,3-b]pyridine-3,4'-piperidine]
Molecular Weight:	279.37
Molecular Formula:	C18H21N3
Canonical SMILES:	C1CN(CCC12CNC3=C2C=CC=N3)CC4=CC=CC=C4
InChI:	InChI=1S/C18H21N3/c1-2-5-15(6-3-1)13-21-11-8-18(9-12-21)14-20-17-16(18)7-4-10-19-17/h1-7,10H,8-9,11-14H2,(H,19,20)
InChI Key:	VUZVTRCSZJXZQL-UHFFFAOYSA-N

Complexity:	342
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	279.173547683
Formal Charge:	0
Heavy Atom Count:	21
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	279.173547683
Rotatable Bond Count:	2
Topological Polar Surface Area:	28.2Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3