9H-pyrido[3,4-b]indole-3-carbonitrile

9H-pyrido[3,4-b]indole-3-carbonitrile

CAS: 83911-48-2

Formula: C12H7N3

SMILES: N#CC1=CC2=C(NC3=C2C=CC=C3)C=N1

IUPAC: 9H-pyrido[3,4-b]indole-3-carbonitrile

InChI: InChI=1S/C12H7N3/c13-6-8-5-10-9-3-1-2-4-11(9)15-12(10)7-14-8/h1-5,7,15H

Composition: C (74.60%), H (3.65%), N (21.75%)

Molar Mass: 193.209

Atom Count: 22

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	193.063997237
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	RYLDZJANGRBUGW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.66
Topological Polar Surface Area	52.47
Polarizability	24.11
Ring Count	3
Rotatable Bond Count	0

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