Home Other Building Blocks 4-[4-(3-methylphenyl)piperazin-1-yl]butan-2-amine

4-[4-(3-methylphenyl)piperazin-1-yl]butan-2-amine

CAS No.:
1087784-53-9
Catalog Number:
AG019MZK
Molecular Formula:
C15H25N3
Molecular Weight:
247.3791
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Product Description
Catalog Number:
AG019MZK
Chemical Name:
4-[4-(3-methylphenyl)piperazin-1-yl]butan-2-amine
CAS Number:
1087784-53-9
Molecular Formula:
C15H25N3
Molecular Weight:
247.3791
MDL Number:
MFCD11099611
IUPAC Name:
4-[4-(3-methylphenyl)piperazin-1-yl]butan-2-amine
InChI:
InChI=1S/C15H25N3/c1-13-4-3-5-15(12-13)18-10-8-17(9-11-18)7-6-14(2)16/h3-5,12,14H,6-11,16H2,1-2H3
InChI Key:
GTWNGHGXDIZFTP-UHFFFAOYSA-N
SMILES:
CC(CCN1CCN(CC1)c1cccc(c1)C)N
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.205g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
247.386g/mol
Monoisotopic Mass:
247.205g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
32.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties