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1-[3-(aminomethyl)piperidin-1-yl]-2,2-dimethylpropan-1-one

1-[3-(aminomethyl)piperidin-1-yl]-2,2-dimethylpropan-1-one

CAS: 942205-86-9

Formula: C11H22N2O

SMILES: CC(C)(C)C(=O)N1CCCC(CN)C1

IUPAC: 1-[3-(aminomethyl)piperidin-1-yl]-2,2-dimethylpropan-1-one

InChI: InChI=1/C11H22N2O/c1-11(2,3)10(14)13-6-4-5-9(7-12)8-13/h9H,4-8,12H2,1-3H3

Composition: C (66.62%), H (11.18%), N (14.13%), O (8.07%)

Molar Mass: 198.31

Atom Count: 36

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 198.173213336
Formal Charge 0
FSP3 0.91
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey AITIEOWRVZTEPT-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.06
Topological Polar Surface Area 46.33
Polarizability 23
Ring Count 1
Rotatable Bond Count 2

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