cis-3-Amino-1-methylcyclobutanol - CAS 1363381-58-1

Catalog:	BB008343
Product Name:	cis-3-Amino-1-methylcyclobutanol
CAS:	1363381-58-1
Synonyms:	3-amino-1-methyl-1-cyclobutanol; 3-amino-1-methylcyclobutan-1-ol

Technical Data

Patents

Computed Properties

IUPAC Name:	3-amino-1-methylcyclobutan-1-ol
Description:	cis-3-Amino-1-methylcyclobutanol (CAS# 1363381-58-1) is used in the preperation of 1,3,4-thiadiazol-2-ylpyridine-4-amines which is an IRAK4 inhibitor, and is used for treatment of inflammatory disorders.
Molecular Weight:	101.15
Molecular Formula:	C5H11NO
Canonical SMILES:	CC1(CC(C1)N)O
InChI:	InChI=1S/C5H11NO/c1-5(7)2-4(6)3-5/h4,7H,2-3,6H2,1H3
InChI Key:	FAAHPGXMUSQMLD-UHFFFAOYSA-N
MDL:	MFCD23105822
LogP:	0.55880

Publication Number	Title	Priority Date
WO-2021212039-A1	Inhibitors of cysteine proteases and methods of use thereof	20200417
WO-2021188948-A1	Mdm2 degraders and uses thereof	20200319
WO-2021158481-A1	Substituted 1,1'-biphenyl compounds and methods using same	20200203
WO-2021114691-A1	Nitrogen-containing ring-fused compound, preparation method therefor and use thereof	20191213
EP-3800188-A1	Substituted pyrazolopyrimidines as irak4 inhibitors	20191002

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Complexity:	76.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	101.084063974
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	101.084063974
Rotatable Bond Count:	0
Topological Polar Surface Area:	46.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.6