(3R)-1-benzylpyrrolidine-3-carbonitrile

(3R)-1-benzylpyrrolidine-3-carbonitrile

CAS: 157528-56-8

Formula: C12H14N2

SMILES: N#C[C@@H]1CCN(CC2=CC=CC=C2)C1

IUPAC: (3R)-1-benzylpyrrolidine-3-carbonitrile

InChI: InChI=1S/C12H14N2/c13-8-12-6-7-14(10-12)9-11-4-2-1-3-5-11/h1-5,12H,6-7,9-10H2/t12-/m0/s1

Composition: C (77.38%), H (7.58%), N (15.04%)

Molar Mass: 186.258

Atom Count: 28

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	186.115698459
Formal Charge	0
FSP3	0.42
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	RYCQUUNQHVAFSM-LBPRGKRZSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.21
Topological Polar Surface Area	27.03
Polarizability	22.03
Ring Count	2
Rotatable Bond Count	2

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