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Home > Other Heterocycles > 1875005-95-0
1875005-95-0 | 1-(1-ethyl-1H-pyrazol-4-yl)-2-azaspiro[3.5]nonane
CAS No: 1875005-95-0 Catalog No: AG01BQFF MDL No:MFCD30501382
Product Description
Catalog Number:
AG01BQFF
Chemical Name:
1-(1-ethyl-1H-pyrazol-4-yl)-2-azaspiro[3.5]nonane
CAS Number:
1875005-95-0
Molecular Formula:
C13H21N3
Molecular Weight:
219.3259
MDL Number:
MFCD30501382
IUPAC Name:
3-(1-ethylpyrazol-4-yl)-2-azaspiro[3.5]nonane
InChI:
InChI=1S/C13H21N3/c1-2-16-9-11(8-15-16)12-13(10-14-12)6-4-3-5-7-13/h8-9,12,14H,2-7,10H2,1H3
InChI Key:
COBTWUXGHPHDFM-UHFFFAOYSA-N
SMILES:
CCn1ncc(c1)C1NCC21CCCCC2
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.174g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.332g/mol
Monoisotopic Mass:
219.174g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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