4-[(4-Amino-1-piperidyl)methyl]benzonitrile Dihydrochloride - CAS 1158365-82-2
Catalog: |
BB003632 |
Product Name: |
4-[(4-Amino-1-piperidyl)methyl]benzonitrile Dihydrochloride |
CAS: |
1158365-82-2 |
Synonyms: |
4-[(4-amino-1-piperidinyl)methyl]benzonitrile;dihydrochloride; 4-[(4-aminopiperidin-1-yl)methyl]benzonitrile;dihydrochloride |
IUPAC Name: | 4-[(4-aminopiperidin-1-yl)methyl]benzonitrile;dihydrochloride |
Description: | 4-[(4-Amino-1-piperidyl)methyl]benzonitrile Dihydrochloride (CAS# 1158365-82-2) is a useful research chemical. |
Molecular Weight: | 288.22 |
Molecular Formula: | C13H19Cl2N3 |
Canonical SMILES: | C1CN(CCC1N)CC2=CC=C(C=C2)C#N.Cl.Cl |
InChI: | InChI=1S/C13H17N3.2ClH/c14-9-11-1-3-12(4-2-11)10-16-7-5-13(15)6-8-16;;/h1-4,13H,5-8,10,15H2;2*1H |
InChI Key: | PEYNABVSERZDTP-UHFFFAOYSA-N |
LogP: | 3.72358 |
Publication Number | Title | Priority Date |
US-2014378429-A1 | Carboxamide, Sulfonamide and Amine Compounds and Methods for Using Them | 20120201 |
US-9409884-B2 | 5- or 6-substituted benzofuran-2-carboxamide compounds and methods for using them | 20120201 |
WO-2013116491-A1 | Carboxamide, sulfonamide and amine compounds and methods for using them | 20120201 |
AU-2011283684-A1 | AMPK-activating heterocyclic compounds and methods for using the same | 20100729 |
AU-2011283684-B2 | AMPK-activating heterocyclic compounds and methods for using the same | 20100729 |
Complexity: | 252 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 3 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 287.095603 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 287.095603 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 53 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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