Home Aminos tert-butyl N-{2-[(6-fluoropyrimidin-4-yl)amino]ethyl}carbamate

tert-butyl N-{2-[(6-fluoropyrimidin-4-yl)amino]ethyl}carbamate

CAS No.:
1699012-21-9
Catalog Number:
AG01C2GS
Molecular Formula:
C11H17FN4O2
Molecular Weight:
256.2767
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Product Description
Catalog Number:
AG01C2GS
Chemical Name:
tert-butyl N-{2-[(6-fluoropyrimidin-4-yl)amino]ethyl}carbamate
CAS Number:
1699012-21-9
Molecular Formula:
C11H17FN4O2
Molecular Weight:
256.2767
MDL Number:
MFCD29054985
IUPAC Name:
tert-butyl N-[2-[(6-fluoropyrimidin-4-yl)amino]ethyl]carbamate
InChI:
InChI=1S/C11H17FN4O2/c1-11(2,3)18-10(17)14-5-4-13-9-6-8(12)15-7-16-9/h6-7H,4-5H2,1-3H3,(H,14,17)(H,13,15,16)
InChI Key:
RUTWFIHOUCMLIN-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCCNc1ncnc(c1)F
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.134g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
256.281g/mol
Monoisotopic Mass:
256.134g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties