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6-chloro-N-(3-methoxypropyl)pyrazin-2-amine

6-chloro-N-(3-methoxypropyl)pyrazin-2-amine

CAS: 941294-49-1

Formula: C8H12ClN3O

SMILES: COCCCNC1=CN=CC(Cl)=N1

IUPAC: 6-chloro-N-(3-methoxypropyl)pyrazin-2-amine

InChI: InChI=1S/C8H12ClN3O/c1-13-4-2-3-11-8-6-10-5-7(9)12-8/h5-6H,2-4H2,1H3,(H,11,12)

Composition: C (47.65%), H (6.00%), Cl (17.58%), N (20.84%), O (7.93%)

Molar Mass: 201.65

Atom Count: 25

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 201.0668897
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey PBVVSSOMJSQOOJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.03
Topological Polar Surface Area 47.04
Polarizability 19.73
Ring Count 1
Rotatable Bond Count 5

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