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1-(6-chloropyridin-3-yl)cyclopropane-1-carboxamide

1-(6-chloropyridin-3-yl)cyclopropane-1-carboxamide

CAS: 854267-91-7

Formula: C9H9ClN2O

SMILES: NC(=O)C1(CC1)C1=CC=C(Cl)N=C1

IUPAC: 1-(6-chloropyridin-3-yl)cyclopropane-1-carboxamide

InChI: InChI=1S/C9H9ClN2O/c10-7-2-1-6(5-12-7)9(3-4-9)8(11)13/h1-2,5H,3-4H2,(H2,11,13)

Composition: C (54.97%), H (4.61%), Cl (18.03%), N (14.25%), O (8.14%)

Molar Mass: 196.63

Atom Count: 22

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 196.0403406
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey NWDOEOQGGNSTBX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 50.17
Topological Polar Surface Area 55.98
Polarizability 19.24
Ring Count 2
Rotatable Bond Count 2

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