spiro[1,3-benzodioxole-2,1'-cyclohexan]-5-amine

spiro[1,3-benzodioxole-2,1'-cyclohexan]-5-amine

CAS: 64179-41-5

Formula: C12H15NO2

SMILES: NC1=CC2=C(OC3(CCCCC3)O2)C=C1

IUPAC: spiro[1,3-benzodioxole-2,1'-cyclohexan]-5-amine

InChI: InChI=1S/C12H15NO2/c13-9-4-5-10-11(8-9)15-12(14-10)6-2-1-3-7-12/h4-5,8H,1-3,6-7,13H2

Composition: C (70.22%), H (7.37%), N (6.82%), O (15.59%)

Molar Mass: 205.257

Atom Count: 30

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	205.110278727
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ZGUHEEOHWIVGOA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.13
Topological Polar Surface Area	44.48
Polarizability	22.41
Ring Count	3
Rotatable Bond Count	0

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