cis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine

C11H23NO — CID 155794326

IUPACcis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine
SMILESCN(C)[C@@H]1CC[C@H]1COC(C)(C)C
InChIInChI=1S/C11H23NO/c1-11(2,3)13-8-9-6-7-10(9)12(4)5/h9-10H,6-8H2,1-5H3/t9-,10+/m0/s1
InChIKeyHTQDWGSHUWSQCD-VHSXEESVSA-N
MW185.31 g/mol
LogP2.14
Rot. Bonds3

About cis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine

cis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine (PubChem CID 155794326) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is cis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine.

Molecular Properties

Compound Namecis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine
PubChem CID155794326
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Namecis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine
SMILESCN(C)[C@@H]1CC[C@H]1COC(C)(C)C
InChIInChI=1S/C11H23NO/c1-11(2,3)13-8-9-6-7-10(9)12(4)5/h9-10H,6-8H2,1-5H3/t9-,10+/m0/s1
InChIKeyHTQDWGSHUWSQCD-VHSXEESVSA-N
XLogP2.14
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze cis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cis-(1R,2S)-1-methoxy-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutane
CID 171453991
N,N-dimethyl-1-[2-[(2-methylpropan-2-yl)oxymethyl]cyclopropyl]methanamine
CID 155794241
N,N-dimethyl-4-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine
CID 155794407
[(1R,2S)-2-(dimethylamino)cyclobutyl]methanol
CID 134691788
N,N-dimethyl-3-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine
CID 155794064
(1S)-1-tert-butyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclopropane
CID 140898338
3-[(2-methylpropan-2-yl)oxymethyl]-1-azabicyclo[2.2.2]octane
CID 58364949
2-(aminomethyl)-N-methyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclohexan-1-amine
CID 112590913
2-(2-aminopropan-2-yl)-N,N-dimethylcyclobutan-1-amine
CID 166979809
N-[2-(aminomethyl)cyclohexyl]-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112603464
4-[(2-methylpropan-2-yl)oxymethyl]piperidine;hydrate
CID 144530470
1,1-dimethyl-3-[(2-methylpropan-2-yl)oxymethyl]cyclohexane
CID 56980867

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine?
The IUPAC name of cis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine (CID 155794326) is cis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine.
What is the SMILES notation for cis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine?
The canonical SMILES for cis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine is CN(C)[C@@H]1CC[C@H]1COC(C)(C)C.
What is the InChIKey of cis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine?
The InChIKey is HTQDWGSHUWSQCD-VHSXEESVSA-N. The full InChI is InChI=1S/C11H23NO/c1-11(2,3)13-8-9-6-7-10(9)12(4)5/h9-10H,6-8H2,1-5H3/t9-,10+/m0/s1.
What are the key properties of cis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine?
cis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine has a molecular weight of 185.31 g/mol, XLogP of 2.14, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2R)-N,N-dimethyl-2-[(2-methylpropan-2-yl)oxymethyl]cyclobutan-1-amine is sourced from PubChem (CID 155794326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).