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Home > Other Heterocycles > 2060060-20-8
2060060-20-8 | 1-[1-(2-methylpropyl)-1H-pyrrol-3-yl]-2-azaspiro[3.5]nonane
CAS No: 2060060-20-8 Catalog No: AG01BQG1 MDL No:MFCD30501404
Product Description
Catalog Number:
AG01BQG1
Chemical Name:
1-[1-(2-methylpropyl)-1H-pyrrol-3-yl]-2-azaspiro[3.5]nonane
CAS Number:
2060060-20-8
Molecular Formula:
C16H26N2
Molecular Weight:
246.3910
MDL Number:
MFCD30501404
IUPAC Name:
3-[1-(2-methylpropyl)pyrrol-3-yl]-2-azaspiro[3.5]nonane
InChI:
InChI=1S/C16H26N2/c1-13(2)10-18-9-6-14(11-18)15-16(12-17-15)7-4-3-5-8-16/h6,9,11,13,15,17H,3-5,7-8,10,12H2,1-2H3
InChI Key:
VDDYPNJDMCOXDM-UHFFFAOYSA-N
SMILES:
CC(Cn1ccc(c1)C1NCC21CCCCC2)C
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.21g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.398g/mol
Monoisotopic Mass:
246.21g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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