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N-{[3-(propan-2-yl)bicyclo[1.1.1]pentan-1-yl]methyl}acetamide

N-{[3-(propan-2-yl)bicyclo[1.1.1]pentan-1-yl]methyl}acetamide - CAS 1886967-34-5

Catalog:	BB014538
Product Name:	N-{[3-(propan-2-yl)bicyclo[1.1.1]pentan-1-yl]methyl}acetamide
CAS:	1886967-34-5
Synonyms:	N-[(3-propan-2-yl-1-bicyclo[1.1.1]pentanyl)methyl]acetamide; N-[(3-propan-2-yl-1-bicyclo[1.1.1]pentanyl)methyl]acetamide

Technical Data

Patents

Computed Properties

IUPAC Name:	N-[(3-propan-2-yl-1-bicyclo[1.1.1]pentanyl)methyl]acetamide
Description:	N-{[3-(propan-2-yl)bicyclo[1.1.1]pentan-1-yl]methyl}acetamide (CAS# 1886967-34-5 ) is a useful research chemical.
Molecular Weight:	181.279
Molecular Formula:	C11H19NO
Canonical SMILES:	CC(C)C12CC(C1)(C2)CNC(=O)C
InChI:	InChI=1S/C11H19NO/c1-8(2)11-4-10(5-11,6-11)7-12-9(3)13/h8H,4-7H2,1-3H3,(H,12,13)
InChI Key:	OQIKTCRZDITXPX-UHFFFAOYSA-N

Publication Number	Title	Priority Date
US-2020270221-A1	Analgesic compounds	20170515
US-10308609-B2	Bicyclic compounds	20140917
US-2016075654-A1	Bicyclic compounds	20140917
US-2019233377-A1	Bicyclic compounds	20140917
US-10975035-B2	Bicyclic compounds	20140917

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Complexity:	225
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	181.14666423
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	181.14666423
Rotatable Bond Count:	3
Topological Polar Surface Area:	29.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7