Home Carbonyls [4-(4-methylpiperazine-1-carbonyl)phenyl]methanamine

[4-(4-methylpiperazine-1-carbonyl)phenyl]methanamine

CAS No.:
923242-81-3
Catalog Number:
AG00IH3J
Molecular Formula:
C13H19N3O
Molecular Weight:
233.3095
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Product Description
Catalog Number:
AG00IH3J
Chemical Name:
[4-(4-methylpiperazine-1-carbonyl)phenyl]methanamine
CAS Number:
923242-81-3
Molecular Formula:
C13H19N3O
Molecular Weight:
233.3095
MDL Number:
MFCD08444570
IUPAC Name:
[4-(aminomethyl)phenyl]-(4-methylpiperazin-1-yl)methanone
InChI:
InChI=1S/C13H19N3O/c1-15-6-8-16(9-7-15)13(17)12-4-2-11(10-14)3-5-12/h2-5H,6-10,14H2,1H3
InChI Key:
ZWBSRIFTHJGMJG-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)C(=O)N1CCN(CC1)C
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.153g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.315g/mol
Monoisotopic Mass:
233.153g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties