2-(5-methoxy-1H-indol-3-yl)acetonitrile

2-(5-methoxy-1H-indol-3-yl)acetonitrile

CAS: 2436-17-1

Formula: C11H10N2O

SMILES: COC1=CC=C2NC=C(CC#N)C2=C1

IUPAC: 2-(5-methoxy-1H-indol-3-yl)acetonitrile

InChI: InChI=1S/C11H10N2O/c1-14-9-2-3-11-10(6-9)8(4-5-12)7-13-11/h2-3,6-7,13H,4H2,1H3

Composition: C (70.95%), H (5.41%), N (15.04%), O (8.59%)

Molar Mass: 186.214

Atom Count: 24

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	186.07931295
Formal Charge	0
FSP3	0.18
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	ZBQCXEREMRGOCO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.89
Topological Polar Surface Area	48.81
Polarizability	21.59
Ring Count	2
Rotatable Bond Count	2

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