1-(5-cyanopyridin-2-yl)cyclopropane-1-carboxylic acid

1-(5-cyanopyridin-2-yl)cyclopropane-1-carboxylic acid

CAS: 2135331-49-4

Formula: C10H8N2O2

SMILES: OC(=O)C1(CC1)C1=CC=C(C=N1)C#N

IUPAC: 1-(5-cyanopyridin-2-yl)cyclopropane-1-carboxylic acid

InChI: InChI=1S/C10H8N2O2/c11-5-7-1-2-8(12-6-7)10(3-4-10)9(13)14/h1-2,6H,3-4H2,(H,13,14)

Composition: C (63.83%), H (4.29%), N (14.89%), O (17.00%)

Molar Mass: 188.186

Atom Count: 22

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	188.058577506
Formal Charge	0
FSP3	0.3
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	JGTJBYSKUOQGKU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.83
Topological Polar Surface Area	73.98
Polarizability	18.45
Ring Count	2
Rotatable Bond Count	2

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