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1-[(3S)-1-methylpiperidin-3-yl]methanamine dihydrochloride

1-[(3S)-1-methylpiperidin-3-yl]methanamine dihydrochloride

CAS: 1400744-19-5

Formula: C7H18Cl2N2

SMILES: Cl.Cl.CN1CCC[C@@H](CN)C1

IUPAC: 1-[(3S)-1-methylpiperidin-3-yl]methanamine dihydrochloride

InChI: InChI=1S/C7H16N2.2ClH/c1-9-4-2-3-7(5-8)6-9;;/h7H,2-6,8H2,1H3;2*1H/t7-;;/m0../s1

Composition: C (41.80%), H (9.02%), Cl (35.25%), N (13.93%)

Molar Mass: 201.14

Atom Count: 29

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 200.084704
Formal Charge 0
FSP3 1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey WGPVXFHARJYQQA-KLXURFKVSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.09
Topological Polar Surface Area 29.26
Polarizability 15.97
Ring Count 1
Rotatable Bond Count 1

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