[1-(Trifluoromethyl)cyclobutyl]methanamineDISCONTINUED - CAS 1522712-18-0

Catalog:	BB056991
Product Name:	[1-(Trifluoromethyl)cyclobutyl]methanamineDISCONTINUED
CAS:	1522712-18-0
Synonyms:	1-(Trifluoromethyl)cyclobutanemethanamine

Technical Data

IUPAC Name:	[1-(trifluoromethyl)cyclobutyl]methanamine
Description:	[1-(Trifluoromethyl)cyclobutyl]methanamine may be useful in the preparation of thieno[2,3-d]pyrimidine-6-carboxamides as androgen receptor modulators for treatment of prostate cancer. It may also be useful in the preparation of aminopyridinyl pyrazolecarboxamides as modulators of RORγt.
Molecular Weight:	153.15
Molecular Formula:	C6H10F3N
Canonical SMILES:	C1CC(C1)(CN)C(F)(F)F
InChI:	InChI=1S/C6H10F3N/c7-6(8,9)5(4-10)2-1-3-5/h1-4,10H2
InChI Key:	RWCORNWVMMMPDS-UHFFFAOYSA-N
References:	Mikochik, P., et al. PCT Int. Appl., 108pp. (2020); Goldberg, S., et al. U.S. Pat. Appl. Publ., 94pp. (2019); Goldberg, S., et al. PCT Int. Appl., 793pp. (2017).

Complexity:	125
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	153.07653381
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	153.07653381
Rotatable Bond Count:	1
Topological Polar Surface Area:	26Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5