2-Methoxy-6-(pyrrolidin-1-yl)nicotinaldehyde - CAS 1228666-11-2
Catalog: |
BB075901 |
Product Name: |
2-Methoxy-6-(pyrrolidin-1-yl)nicotinaldehyde |
CAS: |
1228666-11-2 |
Synonyms: |
2-Methoxy-6-(1-pyrrolidinyl)-3-pyridinecarboxaldehyde |
IUPAC Name: | 2-methoxy-6-pyrrolidin-1-ylpyridine-3-carbaldehyde |
Description: | 2-Methoxy-6-(pyrrolidin-1-yl)nicotinaldehyde |
Molecular Weight: | 206.24 |
Molecular Formula: | C11H14N2O2 |
Canonical SMILES: | COC1=C(C=CC(=N1)N2CCCC2)C=O |
InChI: | InChI=1S/C11H14N2O2/c1-15-11-9(8-14)4-5-10(12-11)13-6-2-3-7-13/h4-5,8H,2-3,6-7H2,1H3 |
InChI Key: | DUXXVGOFEXESLC-UHFFFAOYSA-N |
Complexity: | 217 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.105527694 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.105527694 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 42.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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