N-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine

C13H27NO2 — CID 115972400

IUPACN-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine
SMILESCCOC(C)CNC1CC(OC(C)(C)C)C1
InChIInChI=1S/C13H27NO2/c1-6-15-10(2)9-14-11-7-12(8-11)16-13(3,4)5/h10-12,14H,6-9H2,1-5H3
InChIKeyHBANGDAGLFSJKL-UHFFFAOYSA-N
MW229.36 g/mol
LogP2.35
Rot. Bonds6

About N-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine

N-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine (PubChem CID 115972400) has the molecular formula C13H27NO2 and a molecular weight of 229.36 g/mol. Its IUPAC name is N-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine.

Molecular Properties

Compound NameN-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine
PubChem CID115972400
Molecular FormulaC13H27NO2
Molecular Weight229.36 g/mol
Exact Mass229.20
IUPAC NameN-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine
SMILESCCOC(C)CNC1CC(OC(C)(C)C)C1
InChIInChI=1S/C13H27NO2/c1-6-15-10(2)9-14-11-7-12(8-11)16-13(3,4)5/h10-12,14H,6-9H2,1-5H3
InChIKeyHBANGDAGLFSJKL-UHFFFAOYSA-N
XLogP2.35
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.36
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dimethyl-1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]pentan-2-ol
CID 110010568
N-(2-ethoxypropyl)cyclooctanamine
CID 115724296
tert-butyl 3-(2-ethoxypropylamino)-8-azabicyclo[3.2.1]octane-8-carboxylate
CID 103944098
N-(2-ethoxypropyl)oxan-4-amine
CID 115655582
N-(2-ethoxypropyl)thiolan-3-amine
CID 115724223
2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]propan-1-ol
CID 110010925
methane;N-methyl-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine
CID 158877825
2-methyl-2-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]butan-1-ol
CID 110011598
N-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propyl]cyclopropanamine
CID 112589849
3-[(2-methylpropan-2-yl)oxy]-N-(3-methylsulfanylpropyl)cyclobutan-1-amine
CID 115972032
tert-butyl N-[1-[(3-ethoxycyclobutyl)amino]propan-2-yl]carbamate
CID 107247532
N-(2-propoxypropyl)cyclopropanamine
CID 62451872

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine?
The IUPAC name of N-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine (CID 115972400) is N-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine.
What is the SMILES notation for N-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine?
The canonical SMILES for N-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine is CCOC(C)CNC1CC(OC(C)(C)C)C1.
What is the InChIKey of N-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine?
The InChIKey is HBANGDAGLFSJKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2/c1-6-15-10(2)9-14-11-7-12(8-11)16-13(3,4)5/h10-12,14H,6-9H2,1-5H3.
What are the key properties of N-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine?
N-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine has a molecular weight of 229.36 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxypropyl)-3-[(2-methylpropan-2-yl)oxy]cyclobutan-1-amine is sourced from PubChem (CID 115972400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).