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15828-08-7 | 3-Pyridinecarboxamide, N-(1,1-dimethylethyl)-
CAS No: 15828-08-7 Catalog No: AG001Q3G MDL No:MFCD00707839
Product Description
Catalog Number:
AG001Q3G
Chemical Name:
3-Pyridinecarboxamide, N-(1,1-dimethylethyl)-
CAS Number:
15828-08-7
Molecular Formula:
C10H14N2O
Molecular Weight:
178.2310
MDL Number:
MFCD00707839
IUPAC Name:
N-tert-butylpyridine-3-carboxamide
InChI:
InChI=1S/C10H14N2O/c1-10(2,3)12-9(13)8-5-4-6-11-7-8/h4-7H,1-3H3,(H,12,13)
InChI Key:
UKLIVFNPJKDBAX-UHFFFAOYSA-N
SMILES:
O=C(c1cccnc1)NC(C)(C)C
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.111g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.235g/mol
Monoisotopic Mass:
178.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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