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Home > Pyridines > 1657033-40-3
1657033-40-3 | 1'-methylspiro[piperidine-3,3'-pyrrolo[3,2-b]pyridin]-2'(1'H)-one dihydrochloride
CAS No: 1657033-40-3 Catalog No: AG00J2U7 MDL No:MFCD28398162
Product Description
Catalog Number:
AG00J2U7
Chemical Name:
1'-methylspiro[piperidine-3,3'-pyrrolo[3,2-b]pyridin]-2'(1'H)-one dihydrochloride
CAS Number:
1657033-40-3
Molecular Formula:
C12H17Cl2N3O
Molecular Weight:
290.1889
MDL Number:
MFCD28398162
IUPAC Name:
1'-methylspiro[piperidine-3,3'-pyrrolo[3,2-b]pyridine]-2'-one;dihydrochloride
InChI:
InChI=1S/C12H15N3O.2ClH/c1-15-9-4-2-7-14-10(9)12(11(15)16)5-3-6-13-8-12;;/h2,4,7,13H,3,5-6,8H2,1H3;2*1H
InChI Key:
JJFXCMMDFUNTDT-UHFFFAOYSA-N
SMILES:
O=C1N(C)c2c(C31CCCNC3)nccc2.Cl.Cl
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.075g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
290.188g/mol
Monoisotopic Mass:
289.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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