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1289387-26-3 | 3-Piperidinamine, N-methyl-1-[(2-methylphenyl)methyl]-, hydrochloride (1:1)
CAS No: 1289387-26-3 Catalog No: AG000YMS MDL No:
Product Description
Catalog Number:
AG000YMS
Chemical Name:
3-Piperidinamine, N-methyl-1-[(2-methylphenyl)methyl]-, hydrochloride (1:1)
CAS Number:
1289387-26-3
Molecular Formula:
C14H23ClN2
Molecular Weight:
254.7988
IUPAC Name:
N-methyl-1-[(2-methylphenyl)methyl]piperidin-3-amine;hydrochloride
InChI:
InChI=1S/C14H22N2.ClH/c1-12-6-3-4-7-13(12)10-16-9-5-8-14(11-16)15-2;/h3-4,6-7,14-15H,5,8-11H2,1-2H3;1H
InChI Key:
BMIUHVSXNSUEQP-UHFFFAOYSA-N
SMILES:
CNC1CCCN(C1)Cc1ccccc1C.Cl
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.155g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
254.802g/mol
Monoisotopic Mass:
254.155g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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