4-(Aminomethyl)-1-benzyl-1,2,3,6-tetrahydropyridine - CAS 153196-51-1
Catalog: |
BB010859 |
Product Name: |
4-(Aminomethyl)-1-benzyl-1,2,3,6-tetrahydropyridine |
CAS: |
153196-51-1 |
Synonyms: |
[1-(phenylmethyl)-3,6-dihydro-2H-pyridin-4-yl]methanamine; (1-benzyl-3,6-dihydro-2H-pyridin-4-yl)methanamine |
IUPAC Name: | (1-benzyl-3,6-dihydro-2H-pyridin-4-yl)methanamine |
Description: | 4-(Aminomethyl)-1-benzyl-1,2,3,6-tetrahydropyridine (CAS# 153196-51-1 ) is a useful research chemical. |
Molecular Weight: | 202.30 |
Molecular Formula: | C13H18N2 |
Canonical SMILES: | C1CN(CC=C1CN)CC2=CC=CC=C2 |
InChI: | InChI=1S/C13H18N2/c14-10-12-6-8-15(9-7-12)11-13-4-2-1-3-5-13/h1-6H,7-11,14H2 |
InChI Key: | MXOAGBOBRDXXEO-UHFFFAOYSA-N |
LogP: | 2.41560 |
Publication Number | Title | Priority Date |
US-2021188807-A1 | Compounds active towards nuclear receptors | 20191220 |
WO-2021124279-A1 | Compounds active towards nuclear receptors | 20191220 |
WO-2019213570-A1 | Cancer treatments targeting cancer stem cells | 20180504 |
EP-3787612-A1 | Cancer treatments targeting cancer stem cells | 20180504 |
KR-20210015833-A | Cancer treatment targeting cancer stem cells | 20180504 |
Complexity: | 217 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.146998583 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.146998583 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 29.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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Amines and Anilines
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