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Home > Other Heterocycles > 2060061-58-5
2060061-58-5 | 1-(1-ethyl-1H-pyrrol-3-yl)-2-azaspiro[3.4]octane
CAS No: 2060061-58-5 Catalog No: AG01BQG5 MDL No:MFCD30501408
Product Description
Catalog Number:
AG01BQG5
Chemical Name:
1-(1-ethyl-1H-pyrrol-3-yl)-2-azaspiro[3.4]octane
CAS Number:
2060061-58-5
Molecular Formula:
C13H20N2
Molecular Weight:
204.3113
MDL Number:
MFCD30501408
IUPAC Name:
3-(1-ethylpyrrol-3-yl)-2-azaspiro[3.4]octane
InChI:
InChI=1S/C13H20N2/c1-2-15-8-5-11(9-15)12-13(10-14-12)6-3-4-7-13/h5,8-9,12,14H,2-4,6-7,10H2,1H3
InChI Key:
GQEYNXYPMAMXGQ-UHFFFAOYSA-N
SMILES:
CCn1ccc(c1)C1NCC21CCCC2
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.163g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.317g/mol
Monoisotopic Mass:
204.163g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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