2-Amino-6-(4-fluorophenyl)-5-methyl-4-pyridin-3-ylpyridine-3-carbonitrile
Basic information
- CAS
642007-35-0- Standard SMILES
Cc1c(-c2ccc(F)cc2)nc(N)c(C#N)c1-c1cccnc1- InChIKey
YWOZEQAGDOWQFK-UHFFFAOYSA-N- Molecular formula
- C18H13FN4
- Average molar mass
- 304.3 g/mol
- Monoisotopic mass
- 304.11242459
Names & identifiers
- Preferred name
- 2-Amino-6-(4-fluorophenyl)-5-methyl-4-pyridin-3-ylpyridine-3-carbonitrile
- IUPAC
- 2-amino-6-(4-fluorophenyl)-5-methyl-4-pyridin-3-ylpyridine-3-carbonitrile
Names & synonyms
MLS0003331602-amino-6-(4-fluorophenyl)-5-methyl-4-pyridin-3-ylpyridine-3-carbonitrileSMR0004364112'-Amino-6'-(4-fluoro-phenyl)-5'-methyl-[3,4']bipyridinyl-3'-carbonitrile642007-35-0cid_934091CHEMBL1354099BDBM56751DTXSID901327492HMS2811C21STL339911AKOS022126147
Show more names
2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-pyridyl)nicotinonitrile2'-amino-6'-(4-fluorophenyl)-5'-methyl-3,4'-bipyridine-3'-carbonitrile2'-Amino-6'-(4-fluorophenyl)-5'-methyl[3,4'-bipyridine]-3'-carbonitrile2'-AMINO-6'-(4-FLUOROPHENYL)-5'-METHYL-[3,4'-BIPYRIDINE]-3'-CARBONITRILE2-amino-6-(4-fluorophenyl)-5-methyl-4-(3-pyridinyl)-3-pyridinecarbonitrile2-azanyl-6-(4-fluorophenyl)-5-methyl-4-pyridin-3-yl-pyridine-3-carbonitrile
Database identifiers
- CAS
642007-35-0- PubChem CID
- 934091
- DTXSID
DTXSID901327492- ChEMBL
CHEMBL1354099
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 440
Experimental & physicochemical properties
Solubility3.3 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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