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329042-35-5 | N-(4-Methyl-pyridin-2-yl)-isonicotinamide
CAS No: 329042-35-5 Catalog No: AG01FBQC MDL No:MFCD01338470
Product Description
Catalog Number:
AG01FBQC
Chemical Name:
N-(4-Methyl-pyridin-2-yl)-isonicotinamide
CAS Number:
329042-35-5
Molecular Formula:
C12H11N3O
Molecular Weight:
213.2352
MDL Number:
MFCD01338470
IUPAC Name:
N-(4-methylpyridin-2-yl)pyridine-4-carboxamide
InChI:
InChI=1S/C12H11N3O/c1-9-2-7-14-11(8-9)15-12(16)10-3-5-13-6-4-10/h2-8H,1H3,(H,14,15,16)
InChI Key:
BFZSHHJHKPGVJM-UHFFFAOYSA-N
SMILES:
Cc1ccnc(c1)NC(=O)c1ccncc1
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.24g/mol
Monoisotopic Mass:
213.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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