1-Methyl-1H-indazole-6-methanamine - CAS 267413-31-0

Catalog:	BB056505
Product Name:	1-Methyl-1H-indazole-6-methanamine
CAS:	267413-31-0
Synonyms:	(1-methyl-1H-indazol-6-yl)methanamine; (1-methylindazol-6-yl)methanamine; 1-Methyl-1H-indazole-6-methanamine

Technical Data

IUPAC Name:	(1-methylindazol-6-yl)methanamine
Description:	1-Methyl-Indazole-6-methanamine is a useful synthetic intermediate. It is an analog of 1H-Indazole-5-methanamine (I505500) which is used in the preparation of amide containing heterobicyclic metalloprotease inhibitors.
Molecular Weight:	161.2
Molecular Formula:	C9H11N3
Canonical SMILES:	CN1C2=C(C=CC(=C2)CN)C=N1
InChI:	InChI=1S/C9H11N3/c1-12-9-4-7(5-10)2-3-8(9)6-11-12/h2-4,6H,5,10H2,1H3
InChI Key:	SCHZPLZUVGWXMA-UHFFFAOYSA-N
References:	Evangelista, M., et al. Clin. Cancer Res., 12, 5924 (2006), Pazzaglia, S., et al. Oncogene, 25, 5575 (2006),.

Complexity:	160
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	161.095297364
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	161.095297364
Rotatable Bond Count:	1
Topological Polar Surface Area:	43.8Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1