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145105-04-0 | Pyridine, 2-[1-(phenylmethyl)-3-pyrrolidinyl]-
CAS No: 145105-04-0 Catalog No: AG001KL1 MDL No:MFCD11042353
Product Description
Catalog Number:
AG001KL1
Chemical Name:
Pyridine, 2-[1-(phenylmethyl)-3-pyrrolidinyl]-
CAS Number:
145105-04-0
Molecular Formula:
C16H18N2
Molecular Weight:
238.3275
MDL Number:
MFCD11042353
IUPAC Name:
2-(1-benzylpyrrolidin-3-yl)pyridine
InChI:
InChI=1S/C16H18N2/c1-2-6-14(7-3-1)12-18-11-9-15(13-18)16-8-4-5-10-17-16/h1-8,10,15H,9,11-13H2
InChI Key:
LJPFYXCQPUZKQA-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CN1CCC(C1)c1ccccn1
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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