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1818847-36-7 | Benzenamine, 2-methoxy-4-(9-methyl-3,9-diazaspiro[5.5]undec-3-yl)-
CAS No: 1818847-36-7 Catalog No: AG002363 MDL No:MFCD29060161
Product Description
Catalog Number:
AG002363
Chemical Name:
Benzenamine, 2-methoxy-4-(9-methyl-3,9-diazaspiro[5.5]undec-3-yl)-
CAS Number:
1818847-36-7
Molecular Formula:
C17H27N3O
Molecular Weight:
289.4158
MDL Number:
MFCD29060161
IUPAC Name:
2-methoxy-4-(9-methyl-3,9-diazaspiro[5.5]undecan-3-yl)aniline
InChI:
InChI=1S/C17H27N3O/c1-19-9-5-17(6-10-19)7-11-20(12-8-17)14-3-4-15(18)16(13-14)21-2/h3-4,13H,5-12,18H2,1-2H3
InChI Key:
UHRVNTWMSOLZCG-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1N)N1CCC2(CC1)CCN(CC2)C
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.215g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.423g/mol
Monoisotopic Mass:
289.215g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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