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1,3,8-triazaspiro[4.5]decan-2-one

1,3,8-triazaspiro[4.5]decan-2-one

CAS: 561314-52-1

Formula: C7H13N3O

SMILES: O=C1NCC2(CCNCC2)N1

IUPAC: 1,3,8-triazaspiro[4.5]decan-2-one

InChI: InChI=1S/C7H13N3O/c11-6-9-5-7(10-6)1-3-8-4-2-7/h8H,1-5H2,(H2,9,10,11)

Composition: C (54.17%), H (8.44%), N (27.08%), O (10.31%)

Molar Mass: 155.201

Atom Count: 24

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 155.105862051
Formal Charge 0
FSP3 0.86
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 3
InChIKey XLZONOPLKJMTSW-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 41.01
Topological Polar Surface Area 53.16
Polarizability 16.06
Ring Count 2
Rotatable Bond Count 0

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