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4-(azetidin-3-yl)piperazin-2-one dihydrochloride

4-(azetidin-3-yl)piperazin-2-one dihydrochloride

CAS: 1403766-88-0

Formula: C7H15Cl2N3O

SMILES: Cl.Cl.O=C1CN(CCN1)C1CNC1

IUPAC: 4-(azetidin-3-yl)piperazin-2-one dihydrochloride

InChI: InChI=1S/C7H13N3O.2ClH/c11-7-5-10(2-1-9-7)6-3-8-4-6;;/h6,8H,1-5H2,(H,9,11);2*1H

Composition: C (36.86%), H (6.63%), Cl (31.08%), N (18.42%), O (7.01%)

Molar Mass: 228.12

Atom Count: 28

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 227.0592175
Formal Charge 0
FSP3 0.86
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey WNIJPEUWMRRWNO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 41.25
Topological Polar Surface Area 44.37
Polarizability 16.44
Ring Count 2
Rotatable Bond Count 1

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