2-azabicyclo[2.2.1]hept-5-en-3-one

2-azabicyclo[2.2.1]hept-5-en-3-one

CAS: 49805-30-3

Formula: C6H7NO

SMILES: [H]C12CC([H])(C=C1)C(=O)N2

IUPAC: 2-azabicyclo[2.2.1]hept-5-en-3-one

InChI: InChI=1/C6H7NO/c8-6-4-1-2-5(3-4)7-6/h1-2,4-5H,3H2,(H,7,8)

Composition: C (66.04%), H (6.47%), N (12.84%), O (14.66%)

Molar Mass: 109.128

Atom Count: 15

Heavy Atom Count: 8

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	109.052763849
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	DDUFYKNOXPZZIW-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	30.33
Topological Polar Surface Area	29.1
Polarizability	11.3
Ring Count	2
Rotatable Bond Count	0

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