2-(4-Benzyl-1-piperidinyl)aniline - CAS 455260-03-4
Catalog: |
BB025913 |
Product Name: |
2-(4-Benzyl-1-piperidinyl)aniline |
CAS: |
455260-03-4 |
Synonyms: |
2-[4-(phenylmethyl)-1-piperidinyl]aniline; 2-(4-benzylpiperidin-1-yl)aniline |
IUPAC Name: | 2-(4-benzylpiperidin-1-yl)aniline |
Description: | 2-(4-Benzyl-1-piperidinyl)aniline (CAS# 455260-03-4 ) is a useful research chemical. |
Molecular Weight: | 266.38 |
Molecular Formula: | C18H22N2 |
Canonical SMILES: | C1CN(CCC1CC2=CC=CC=C2)C3=CC=CC=C3N |
InChI: | InChI=1S/C18H22N2/c19-17-8-4-5-9-18(17)20-12-10-16(11-13-20)14-15-6-2-1-3-7-15/h1-9,16H,10-14,19H2 |
InChI Key: | BWCLECGAOAWVIM-UHFFFAOYSA-N |
LogP: | 4.37410 |
Publication Number | Title | Priority Date |
US-2002115671-A1 | Inhibitors of p38-a kinase | 19990827 |
US-6541477-B2 | Inhibitors of p38-a kinase | 19990827 |
Complexity: | 277 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 266.17829871 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 266.17829871 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 29.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.1 |
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