1-Boc-3-(1-phenylethylamino)-4-piperidinemethanol - CAS 1305320-69-7
Catalog: |
BB007131 |
Product Name: |
1-Boc-3-(1-phenylethylamino)-4-piperidinemethanol |
CAS: |
1305320-69-7 |
Synonyms: |
4-(hydroxymethyl)-3-(1-phenylethylamino)-1-piperidinecarboxylic acid tert-butyl ester; tert-butyl 4-(hydroxymethyl)-3-(1-phenylethylamino)piperidine-1-carboxylate |
IUPAC Name: | tert-butyl 4-(hydroxymethyl)-3-(1-phenylethylamino)piperidine-1-carboxylate |
Description: | 1-Boc-3-(1-phenylethylamino)-4-piperidinemethanol (CAS# 1305320-69-7 ) is a useful research chemical. |
Molecular Weight: | 334.45 |
Molecular Formula: | C19H30N2O3 |
Canonical SMILES: | CC(C1=CC=CC=C1)NC2CN(CCC2CO)C(=O)OC(C)(C)C |
InChI: | InChI=1S/C19H30N2O3/c1-14(15-8-6-5-7-9-15)20-17-12-21(11-10-16(17)13-22)18(23)24-19(2,3)4/h5-9,14,16-17,20,22H,10-13H2,1-4H3 |
InChI Key: | HGOOISFRTZCVFQ-UHFFFAOYSA-N |
LogP: | 3.28390 |
Publication Number | Title | Priority Date |
US-2010144700-A1 | Heterocyclic-carbonyl-diazabicycloalkanes as modulators of the neuronal nicotinic acetylcholine alpha 4 beta 2, subtype receptor for the treatment of cns related disorders | 20070313 |
EP-2316836-A1 | Substituted diazabicycloalkane derivatives as ligands at alpha 7 nicotinic acetylcholine receptors | 20030919 |
US-2005065178-A1 | Substituted diazabicycloakane derivatives | 20030919 |
US-2005101602-A1 | Substituted diazabicycloalkane derivatives | 20030919 |
US-2008275048-A1 | Substituted Diazabicycloalkane Derivates | 20030919 |
Complexity: | 402 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 334.22564282 |
Formal Charge: | 0 |
Heavy Atom Count: | 24 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 334.22564282 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 61.8 |
Undefined Atom Stereocenter Count: | 3 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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