(1R-exo)-N-(1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl)-2-pyridinemethanamine - CAS 157160-18-4

Catalog:	BB057292
Product Name:	(1R-exo)-N-(1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl)-2-pyridinemethanamine
CAS:	157160-18-4
Synonyms:	N-[(1R,2R,4R)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl]-2-pyridinemethanamine

Technical Data

IUPAC Name:	(1R)-1,7,7-trimethyl-N-(pyridin-2-ylmethyl)bicyclo[2.2.1]heptan-2-amine
Description:	(1R-exo)-N-(1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl)-2-pyridinemethanamine, is a pyridine derivative that can be used in the synthesis of nicotine analogs as potential insecticides.
Molecular Weight:	244.38
Molecular Formula:	C16H24N2
Canonical SMILES:	CC1(C2CCC1(C(C2)NCC3=CC=CC=N3)C)C
InChI:	InChI=1S/C16H24N2/c1-15(2)12-7-8-16(15,3)14(10-12)18-11-13-6-4-5-9-17-13/h4-6,9,12,14,18H,7-8,10-11H2,1-3H3/t12?,14?,16-/m0/s1
InChI Key:	GWIRNARPJMQEML-PXCJXSSVSA-N
References:	Kollmeyer, W., et al. Toky: Spri. Ver., 71, (1999).

Complexity:	312
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	244.193948774
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	244.193948774
Rotatable Bond Count:	3
Topological Polar Surface Area:	24.9Å²
Undefined Atom Stereocenter Count:	2
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2