4-amino-1H-indole-6-carbonitrile

4-amino-1H-indole-6-carbonitrile

CAS: 885518-39-8

Formula: C9H7N3

SMILES: NC1=C2C=CNC2=CC(=C1)C#N

IUPAC: 4-amino-1H-indole-6-carbonitrile

InChI: InChI=1S/C9H7N3/c10-5-6-3-8(11)7-1-2-12-9(7)4-6/h1-4,12H,11H2

Composition: C (68.78%), H (4.49%), N (26.74%)

Molar Mass: 157.176

Atom Count: 19

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	157.063997237
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	ALWCMYAKSPSBAN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.57
Topological Polar Surface Area	65.6
Polarizability	18.53
Ring Count	2
Rotatable Bond Count	0

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