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84176-78-3 | 4-Piperidinemethanamine,4-(phenylamino)-1-(phenylmethyl)-
CAS No: 84176-78-3 Catalog No: AG004SGK MDL No:
Product Description
Catalog Number:
AG004SGK
Chemical Name:
4-Piperidinemethanamine,4-(phenylamino)-1-(phenylmethyl)-
CAS Number:
84176-78-3
Molecular Formula:
C19H25N3
Molecular Weight:
295.4219
IUPAC Name:
4-(aminomethyl)-1-benzyl-N-phenylpiperidin-4-amine
InChI:
InChI=1S/C19H25N3/c20-16-19(21-18-9-5-2-6-10-18)11-13-22(14-12-19)15-17-7-3-1-4-8-17/h1-10,21H,11-16,20H2
InChI Key:
BLJAWOMRSNJSGJ-UHFFFAOYSA-N
SMILES:
NCC1(CCN(CC1)Cc1ccccc1)Nc1ccccc1
EC Number:
282-345-9
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.205g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
295.43g/mol
Monoisotopic Mass:
295.205g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
41.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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