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Home > Pyridines > 1171920-06-1
1171920-06-1 | tert-Butyl (5-pivalamidopyridin-3-yl)methylcarbamate
CAS No: 1171920-06-1 Catalog No: AG00HDV2 MDL No:MFCD12922729
Product Description
Catalog Number:
AG00HDV2
Chemical Name:
tert-Butyl (5-pivalamidopyridin-3-yl)methylcarbamate
CAS Number:
1171920-06-1
Molecular Formula:
C16H25N3O3
Molecular Weight:
307.3880
MDL Number:
MFCD12922729
IUPAC Name:
tert-butyl N-[[5-(2,2-dimethylpropanoylamino)pyridin-3-yl]methyl]carbamate
InChI:
InChI=1S/C16H25N3O3/c1-15(2,3)13(20)19-12-7-11(8-17-10-12)9-18-14(21)22-16(4,5)6/h7-8,10H,9H2,1-6H3,(H,18,21)(H,19,20)
InChI Key:
KEIVTOMJUMVZDI-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCc1cncc(c1)NC(=O)C(C)(C)C
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.19g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
307.394g/mol
Monoisotopic Mass:
307.19g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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