N-Methyl-1-(pyrimidin-2-yl)methanamine Hydrochloride

Catalog:	BB076227
Product Name:	N-Methyl-1-(pyrimidin-2-yl)methanamine Hydrochloride
Synonyms:	N-Methyl-1-(pyrimidin-2-yl)methanamine hydrochloride; N-METHYL-2-PYRIMIDINEMETHANAMINE HCL; N-Methyl-1-(pyrimidin-2-yl)methanaminehydrochloride; N-METHYL-2-PYRIMIDINEMETHANAMINE HYDROCHLORIDE

Technical Data

IUPAC Name:	N-methyl-1-pyrimidin-2-ylmethanaminehydrochloride
Description:	N-Methyl-1-(pyrimidin-2-yl)methanamine Hydrochloride is a salt analog of N-Methyl-1-(pyrimidin-2-yl)methanamine (CAS# 1083246-53-0), which may be useful in the preparation of (hetero)arylalkylamino-pyrazolopyridazine derivatives having multimodal activity against pain.
Molecular Weight:	159.62
Molecular Formula:	C6H9N3·HCl
Canonical SMILES:	CNCC1=NC=CC=N1.Cl
InChI:	InChI=1S/C6H9N3.ClH/c1-7-5-6-8-3-2-4-9-6/h2-4,7H,5H2,1H31H
InChI Key:	NYRKIRRMUHUJAZ-UHFFFAOYSA-N
References:	Yenes-Minguez, S., et al. PCT Int. Appl., WO 2018219927, 173pp. (2018).

Complexity:	68.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	159.056325
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	159.056325
Rotatable Bond Count:	2
Topological Polar Surface Area:	37.8Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0