2-Fluoro-6-(pyrrolidin-1-yl)nicotinic Acid - CAS 1203499-55-1
Catalog: |
BB065092 |
Product Name: |
2-Fluoro-6-(pyrrolidin-1-yl)nicotinic Acid |
CAS: |
1203499-55-1 |
Synonyms: |
2-Fluoro-6-(pyrrolidin-1-yl)nicotinic acid; 2-fluoro-6-pyrrolidin-1-ylpyridine-3-carboxylic acid |
IUPAC Name: | 2-fluoro-6-pyrrolidin-1-ylpyridine-3-carboxylic acid |
Molecular Weight: | 210.21 |
Molecular Formula: | C10H11FN2O2 |
Canonical SMILES: | C1CCN(C1)C2=NC(=C(C=C2)C(=O)O)F |
InChI: | InChI=1S/C10H11FN2O2/c11-9-7(10(14)15)3-4-8(12-9)13-5-1-2-6-13/h3-4H,1-2,5-6H2,(H,14,15) |
InChI Key: | SLLMHRMILPEKNY-UHFFFAOYSA-N |
Complexity: | 244 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.08045576 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.08045576 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 53.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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