Home Other Building Blocks (3-((4-Methylpiperazin-1-yl)Methyl)phenyl)MethanaMine

(3-((4-Methylpiperazin-1-yl)Methyl)phenyl)MethanaMine

CAS No.:
515162-19-3
Catalog Number:
AG00DKEI
Molecular Formula:
C13H21N3
Molecular Weight:
219.3259
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Product Description
Catalog Number:
AG00DKEI
Chemical Name:
(3-((4-Methylpiperazin-1-yl)Methyl)phenyl)MethanaMine
CAS Number:
515162-19-3
Molecular Formula:
C13H21N3
Molecular Weight:
219.3259
IUPAC Name:
[3-[(4-methylpiperazin-1-yl)methyl]phenyl]methanamine
InChI:
InChI=1S/C13H21N3/c1-15-5-7-16(8-6-15)11-13-4-2-3-12(9-13)10-14/h2-4,9H,5-8,10-11,14H2,1H3
InChI Key:
HMWCORSELDZBCN-UHFFFAOYSA-N
SMILES:
NCc1cccc(c1)CN1CCN(CC1)C
Properties
Complexity:
199  
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:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.332g/mol
Monoisotopic Mass:
219.174g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
32.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties