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Home > Other Heterocycles > 1422138-92-8
1422138-92-8 | 1-[(1-methylpyrazol-3-yl)methyl]-4-oxa-1,9-diazaspiro[5.5]undecane
CAS No: 1422138-92-8 Catalog No: AG01DHND MDL No:
Product Description
Catalog Number:
AG01DHND
Chemical Name:
1-[(1-methylpyrazol-3-yl)methyl]-4-oxa-1,9-diazaspiro[5.5]undecane
CAS Number:
1422138-92-8
Molecular Formula:
C13H22N4O
Molecular Weight:
250.3400
IUPAC Name:
1-[(1-methylpyrazol-3-yl)methyl]-4-oxa-1,9-diazaspiro[5.5]undecane
InChI:
InChI=1S/C13H22N4O/c1-16-7-2-12(15-16)10-17-8-9-18-11-13(17)3-5-14-6-4-13/h2,7,14H,3-6,8-11H2,1H3
InChI Key:
OUUUONGFIDXBLN-UHFFFAOYSA-N
SMILES:
Cn1ccc(n1)CN1CCOCC21CCNCC2
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.179g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.346g/mol
Monoisotopic Mass:
250.179g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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