3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine

C13H27NO2 — CID 102695971

IUPAC3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine
SMILESCCOC1CC(NCC(C)OC)C1(C)CC
InChIInChI=1S/C13H27NO2/c1-6-13(4)11(8-12(13)16-7-2)14-9-10(3)15-5/h10-12,14H,6-9H2,1-5H3
InChIKeyFVNPJPIMGRAXAE-UHFFFAOYSA-N
MW229.36 g/mol
LogP2.20
Rot. Bonds7

About 3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine

3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine (PubChem CID 102695971) has the molecular formula C13H27NO2 and a molecular weight of 229.36 g/mol. Its IUPAC name is 3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine.

Molecular Properties

Compound Name3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine
PubChem CID102695971
Molecular FormulaC13H27NO2
Molecular Weight229.36 g/mol
Exact Mass229.20
IUPAC Name3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine
SMILESCCOC1CC(NCC(C)OC)C1(C)CC
InChIInChI=1S/C13H27NO2/c1-6-13(4)11(8-12(13)16-7-2)14-9-10(3)15-5/h10-12,14H,6-9H2,1-5H3
InChIKeyFVNPJPIMGRAXAE-UHFFFAOYSA-N
XLogP2.20
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.36
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethoxy-2,2-diethyl-N-methylcyclobutan-1-amine hydrochloride
CID 71755574
2,2-diethyl-3-methoxy-N-methylcyclobutan-1-amine hydrochloride
CID 71756393
3-ethoxy-2,2-dimethyl-N-[1-(4-methylmorpholin-2-yl)ethyl]cyclobutan-1-amine
CID 75483286
3-ethoxy-2,2-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclobutan-1-amine
CID 64850373
2,2-dimethyl-3-(2-methylpropoxy)-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclobutan-1-amine
CID 64850406
3-ethoxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]spiro[3.4]octan-1-amine
CID 64865232
3-ethoxy-2-ethyl-2-methyl-N-(3,3,3-trifluoropropyl)cyclobutan-1-amine
CID 65169660
3-ethoxy-2-ethyl-2-methyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclobutan-1-amine
CID 65169663
3-ethoxy-2-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)cyclobutan-1-amine
CID 65170651
3-ethoxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]spiro[3.3]heptan-1-amine
CID 65294628
N,2-diethyl-2-methyl-3-(1,1,1-trifluoropropan-2-yloxy)cyclobutan-1-amine
CID 66349871
2,2-diethyl-N-propyl-3-(1,1,1-trifluoropropan-2-yloxy)cyclobutan-1-amine
CID 66350306

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine?
The IUPAC name of 3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine (CID 102695971) is 3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine.
What is the SMILES notation for 3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine?
The canonical SMILES for 3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine is CCOC1CC(NCC(C)OC)C1(C)CC.
What is the InChIKey of 3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine?
The InChIKey is FVNPJPIMGRAXAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2/c1-6-13(4)11(8-12(13)16-7-2)14-9-10(3)15-5/h10-12,14H,6-9H2,1-5H3.
What are the key properties of 3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine?
3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine has a molecular weight of 229.36 g/mol, XLogP of 2.20, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-2-ethyl-N-(2-methoxypropyl)-2-methylcyclobutan-1-amine is sourced from PubChem (CID 102695971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).