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Home > Other Heterocycles > 2060041-77-0
2060041-77-0 | 1-(1-ethyl-1H-pyrrol-3-yl)-2-azaspiro[3.5]nonane
CAS No: 2060041-77-0 Catalog No: AG01BQG9 MDL No:MFCD30501412
Product Description
Catalog Number:
AG01BQG9
Chemical Name:
1-(1-ethyl-1H-pyrrol-3-yl)-2-azaspiro[3.5]nonane
CAS Number:
2060041-77-0
Molecular Formula:
C14H22N2
Molecular Weight:
218.3379
MDL Number:
MFCD30501412
IUPAC Name:
3-(1-ethylpyrrol-3-yl)-2-azaspiro[3.5]nonane
InChI:
InChI=1S/C14H22N2/c1-2-16-9-6-12(10-16)13-14(11-15-13)7-4-3-5-8-14/h6,9-10,13,15H,2-5,7-8,11H2,1H3
InChI Key:
XVJSEGYKMFBBQZ-UHFFFAOYSA-N
SMILES:
CCn1ccc(c1)C1NCC21CCCCC2
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.178g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.344g/mol
Monoisotopic Mass:
218.178g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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