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90145-50-9 | 4-Pyridinecarboxamide, 3-(2,2-dimethylpropyl)-
CAS No: 90145-50-9 Catalog No: AG00H70N MDL No:
Product Description
Catalog Number:
AG00H70N
Chemical Name:
4-Pyridinecarboxamide, 3-(2,2-dimethylpropyl)-
CAS Number:
90145-50-9
Molecular Formula:
C11H16N2O
Molecular Weight:
192.2575
IUPAC Name:
3-(2,2-dimethylpropyl)pyridine-4-carboxamide
InChI:
InChI=1S/C11H16N2O/c1-11(2,3)6-8-7-13-5-4-9(8)10(12)14/h4-5,7H,6H2,1-3H3,(H2,12,14)
InChI Key:
DKYKUAOGLMTGGV-UHFFFAOYSA-N
SMILES:
NC(=O)c1ccncc1CC(C)(C)C
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.126g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.262g/mol
Monoisotopic Mass:
192.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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