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Home > Other Heterocycles > 2059993-35-8
2059993-35-8 | 1-[1-(2-methylpropyl)-1H-pyrazol-4-yl]-2-azaspiro[3.5]nonane
CAS No: 2059993-35-8 Catalog No: AG01BQFT MDL No:MFCD30501396
Product Description
Catalog Number:
AG01BQFT
Chemical Name:
1-[1-(2-methylpropyl)-1H-pyrazol-4-yl]-2-azaspiro[3.5]nonane
CAS Number:
2059993-35-8
Molecular Formula:
C15H25N3
Molecular Weight:
247.3791
MDL Number:
MFCD30501396
IUPAC Name:
3-[1-(2-methylpropyl)pyrazol-4-yl]-2-azaspiro[3.5]nonane
InChI:
InChI=1S/C15H25N3/c1-12(2)9-18-10-13(8-17-18)14-15(11-16-14)6-4-3-5-7-15/h8,10,12,14,16H,3-7,9,11H2,1-2H3
InChI Key:
BGZGNZOCEFFNBN-UHFFFAOYSA-N
SMILES:
CC(Cn1ncc(c1)C1NCC21CCCCC2)C
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.205g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.386g/mol
Monoisotopic Mass:
247.205g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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