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Home Other Building Blocks Cyclopentanamine, 1-phenyl-

Cyclopentanamine, 1-phenyl-

CAS No.:
17380-74-4
Catalog Number:
AG001Z7V
Molecular Formula:
C11H15N
Molecular Weight:
161.2435
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Product Description
Catalog Number:
AG001Z7V
Chemical Name:
Cyclopentanamine, 1-phenyl-
CAS Number:
17380-74-4
Molecular Formula:
C11H15N
Molecular Weight:
161.2435
MDL Number:
MFCD09903679
IUPAC Name:
1-phenylcyclopentan-1-amine
InChI:
InChI=1S/C11H15N/c12-11(8-4-5-9-11)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9,12H2
InChI Key:
YXAQCAOJLDGGDZ-UHFFFAOYSA-N
SMILES:
NC1(CCCC1)c1ccccc1
Properties
Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.12g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
161.248g/mol
Monoisotopic Mass:
161.12g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Literature
Title Journal
Structure-guided design and synthesis of P1' position 1-phenylcycloalkylamine-derived pentapeptidic BACE1 inhibitors. Bioorganic & medicinal chemistry 20110901
Adaptive neuro-fuzzy inference system (ANFIS): a new approach to predictive modeling in QSAR applications: a study of neuro-fuzzy modeling of PCP-based NMDA receptor antagonists. Bioorganic & medicinal chemistry 20070615
Properties