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N-cyclohexyl-5-methyl-3-nitropyridin-2-amine

N-cyclohexyl-5-methyl-3-nitropyridin-2-amine

CAS: 1033202-68-4

Formula: C12H17N3O2

SMILES: CC1=CN=C(NC2CCCCC2)C(=C1)[N+]([O-])=O

IUPAC: N-cyclohexyl-5-methyl-3-nitropyridin-2-amine

InChI: InChI=1S/C12H17N3O2/c1-9-7-11(15(16)17)12(13-8-9)14-10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3,(H,13,14)

Composition: C (61.26%), H (7.28%), N (17.86%), O (13.60%)

Molar Mass: 235.287

Atom Count: 34

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 235.132076799
Formal Charge 0
FSP3 0.58
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey BXHCZXDTWIBMSH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.78
Topological Polar Surface Area 68.06
Polarizability 24.54
Ring Count 2
Rotatable Bond Count 3

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