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145105-05-1

145105-05-1 | Pyridine, 3-[1-(phenylmethyl)-3-pyrrolidinyl]-

CAS No: 145105-05-1 Catalog No: AG001KL0 MDL No:MFCD13190390

Product Description

Catalog Number:
AG001KL0
Chemical Name:
Pyridine, 3-[1-(phenylmethyl)-3-pyrrolidinyl]-
CAS Number:
145105-05-1
Molecular Formula:
C16H18N2
Molecular Weight:
238.3275
MDL Number:
MFCD13190390
IUPAC Name:
3-(1-benzylpyrrolidin-3-yl)pyridine
InChI:
InChI=1S/C16H18N2/c1-2-5-14(6-3-1)12-18-10-8-16(13-18)15-7-4-9-17-11-15/h1-7,9,11,16H,8,10,12-13H2
InChI Key:
TZXWQOSUDSSVMQ-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CN1CCC(C1)c1cccnc1

Properties

Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.147g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.334g/mol
Monoisotopic Mass:
238.147g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
16.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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