2-amino-4H,5H,6H-cyclopenta[b]thiophene-3-carbonitrile

2-amino-4H,5H,6H-cyclopenta[b]thiophene-3-carbonitrile

CAS: 70291-62-2

Formula: C8H8N2S

SMILES: NC1=C(C#N)C2=C(CCC2)S1

IUPAC: 2-amino-4H,5H,6H-cyclopenta[b]thiophene-3-carbonitrile

InChI: InChI=1S/C8H8N2S/c9-4-6-5-2-1-3-7(5)11-8(6)10/h1-3,10H2

Composition: C (58.51%), H (4.91%), N (17.06%), S (19.52%)

Molar Mass: 164.23

Atom Count: 19

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	164.04081944
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	RILAXFOADRDGPQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.57
Topological Polar Surface Area	49.81
Polarizability	16.6
Ring Count	2
Rotatable Bond Count	0

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