2-Amino-n-methylpyridine-4-carboxamide - CAS 1211295-76-9

Catalog:	BB074436
Product Name:	2-Amino-n-methylpyridine-4-carboxamide
CAS:	1211295-76-9
Synonyms:	2-Amino-N-methyl-4-pyridinecarboxamide; 2-Amino-N-methylisonicotinamide

Technical Data

IUPAC Name:	2-amino-N-methylpyridine-4-carboxamide
Description:	2-Amino-n-methylpyridine-4-carboxamide can be used as SCDs modulators to treat or prevent neurological disorders and primary brain cancer.
Molecular Weight:	151.16
Molecular Formula:	C7H9N3O
Canonical SMILES:	CNC(=O)C1=CC(=NC=C1)N
InChI:	InChI=1S/C7H9N3O/c1-9-7(11)5-2-3-10-6(8)4-5/h2-4H,1H3,(H2,8,10)(H,9,11)
InChI Key:	XSCHKENVJHVZOI-UHFFFAOYSA-N
Melting Point:	>155 °C (dec.)
Solubility:	DMSO (Slightly, Sonicated), Methanol (Slightly, Sonicated)
Appearance:	Pale Beige to Brown Solid
Storage:	4°C
References:	Le Bourdonnec, B., et.al. PCT Int. Appl., 433, (2020).

Complexity:	149
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	151.074561919
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	151.074561919
Rotatable Bond Count:	1
Topological Polar Surface Area:	68Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.2