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Home > Other Heterocycles > 1422135-24-7
1422135-24-7 | 2-(1-methyl-1H-pyrazol-4-yl)-2,7-diazaspiro[4.5]decan-1-one
CAS No: 1422135-24-7 Catalog No: AG01DKIL MDL No:
Product Description
Catalog Number:
AG01DKIL
Chemical Name:
2-(1-methyl-1H-pyrazol-4-yl)-2,7-diazaspiro[4.5]decan-1-one
CAS Number:
1422135-24-7
Molecular Formula:
C12H18N4O
Molecular Weight:
234.2975
IUPAC Name:
2-(1-methylpyrazol-4-yl)-2,9-diazaspiro[4.5]decan-1-one
InChI:
InChI=1S/C12H18N4O/c1-15-8-10(7-14-15)16-6-4-12(11(16)17)3-2-5-13-9-12/h7-8,13H,2-6,9H2,1H3
InChI Key:
IIYCNBIIJYMHIE-UHFFFAOYSA-N
SMILES:
Cn1ncc(c1)N1CCC2(C1=O)CCCNC2
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.148g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.303g/mol
Monoisotopic Mass:
234.148g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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