N-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine

C17H28N2O2 — CID 146520477

IUPACN-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine
SMILESCC(C)COc1ccc(OC2CC(NC(C)(C)C)C2)nc1
InChIInChI=1S/C17H28N2O2/c1-12(2)11-20-14-6-7-16(18-10-14)21-15-8-13(9-15)19-17(3,4)5/h6-7,10,12-13,15,19H,8-9,11H2,1-5H3
InChIKeyWWKFDTATUKUFLC-UHFFFAOYSA-N
MW292.42 g/mol
LogP3.41
Rot. Bonds6

About N-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine

N-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine (PubChem CID 146520477) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is N-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine.

Molecular Properties

Compound NameN-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine
PubChem CID146520477
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC NameN-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine
SMILESCC(C)COc1ccc(OC2CC(NC(C)(C)C)C2)nc1
InChIInChI=1S/C17H28N2O2/c1-12(2)11-20-14-6-7-16(18-10-14)21-15-8-13(9-15)19-17(3,4)5/h6-7,10,12-13,15,19H,8-9,11H2,1-5H3
InChIKeyWWKFDTATUKUFLC-UHFFFAOYSA-N
XLogP3.41
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(2-methylpropane)
CID 167704162
3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]-N-propan-2-ylcyclobutan-1-amine
CID 155215049
3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine
CID 134335610
ethane;1-[[6-[3-(methylamino)cyclobutyl]oxy-3-pyridinyl]oxy]propan-2-one
CID 142368291
N-[3-[[5-(3-methyl-2-oxobutoxy)-2-pyridinyl]oxy]cyclobutyl]methanesulfinothioamide
CID 146520687
1-[[6-[3-(1-sulfanylethylamino)cyclobutyl]oxy-3-pyridinyl]oxy]butan-2-one
CID 155321947
N-[6-[[6-[3-(tert-butylamino)cyclobutyl]oxy-3-pyridinyl]oxy]-2,5,5-trimethylhexan-2-yl]-1-(4-tert-butyl-2-pyridinyl)pyrrolidin-3-amine
CID 146179558
3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]-N-[(2S)-3-methylbutan-2-yl]cyclobutan-1-amine
CID 146548076
N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]ethanamine
CID 83127836
2-cyclohexyloxy-5-methoxypyridine
CID 170010378
N-tert-butyl-3-[[4-[5-[[3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutyl]amino]-2,5-dimethylhexan-2-yl]-2-pyridinyl]oxy]cyclobutan-1-amine
CID 134414186
N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]methyl]cyclobutan-1-amine
CID 177124053

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine?
The IUPAC name of N-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine (CID 146520477) is N-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine.
What is the SMILES notation for N-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine?
The canonical SMILES for N-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine is CC(C)COc1ccc(OC2CC(NC(C)(C)C)C2)nc1.
What is the InChIKey of N-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine?
The InChIKey is WWKFDTATUKUFLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-12(2)11-20-14-6-7-16(18-10-14)21-15-8-13(9-15)19-17(3,4)5/h6-7,10,12-13,15,19H,8-9,11H2,1-5H3.
What are the key properties of N-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine?
N-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine has a molecular weight of 292.42 g/mol, XLogP of 3.41, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-3-[[5-(2-methylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine is sourced from PubChem (CID 146520477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).