2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine

C17H27NO — CID 62116834

IUPAC2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine
SMILESCCNC(COC1CCC1)c1c(C)cc(C)cc1C
InChIInChI=1S/C17H27NO/c1-5-18-16(11-19-15-7-6-8-15)17-13(3)9-12(2)10-14(17)4/h9-10,15-16,18H,5-8,11H2,1-4H3
InChIKeyVKUITDBNJPLIDU-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.83
Rot. Bonds6

About 2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine

2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine (PubChem CID 62116834) has the molecular formula C17H27NO and a molecular weight of 261.41 g/mol. Its IUPAC name is 2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine.

Molecular Properties

Compound Name2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine
PubChem CID62116834
Molecular FormulaC17H27NO
Molecular Weight261.41 g/mol
Exact Mass261.21
IUPAC Name2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine
SMILESCCNC(COC1CCC1)c1c(C)cc(C)cc1C
InChIInChI=1S/C17H27NO/c1-5-18-16(11-19-15-7-6-8-15)17-13(3)9-12(2)10-14(17)4/h9-10,15-16,18H,5-8,11H2,1-4H3
InChIKeyVKUITDBNJPLIDU-UHFFFAOYSA-N
XLogP3.83
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-ethoxycyclobutyl)-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine
CID 103162901
2-cyclobutyloxy-N-ethyl-1-(4-propylphenyl)ethanamine
CID 62116839
1-(3,4-dimethylphenyl)-N-ethyl-2-(3-methylcyclohexyl)oxyethanamine
CID 63474390
N-[2-cyclohexyloxy-1-(2,4-dimethylphenyl)ethyl]propan-1-amine
CID 63475749
2-cyclobutyloxy-1-(2-ethoxyphenyl)-N-ethylethanamine
CID 62114747
2-cyclobutyloxy-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-ethylethanamine
CID 62116838
N-ethyl-3,3-dimethyl-1-(2,4,6-trimethylphenyl)butan-1-amine
CID 43491139
2-(3-ethoxycyclobutyl)-N-ethyl-1-(2-fluoro-4,6-dimethylphenyl)ethanamine
CID 106883381
N-ethyl-1-(2,4,6-trimethylphenyl)hexan-1-amine
CID 43491113
N-ethyl-2-(2-methylpiperidin-1-yl)-1-(2,4,6-trimethylphenyl)ethanamine
CID 63465659
3-cyclopentyl-N-ethyl-1-(2-fluoro-4,6-dimethylphenyl)propan-1-amine
CID 106883936
N-(cyclopropylmethyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine
CID 65382922

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine?
The IUPAC name of 2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine (CID 62116834) is 2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine.
What is the SMILES notation for 2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine?
The canonical SMILES for 2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine is CCNC(COC1CCC1)c1c(C)cc(C)cc1C.
What is the InChIKey of 2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine?
The InChIKey is VKUITDBNJPLIDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO/c1-5-18-16(11-19-15-7-6-8-15)17-13(3)9-12(2)10-14(17)4/h9-10,15-16,18H,5-8,11H2,1-4H3.
What are the key properties of 2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine?
2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine has a molecular weight of 261.41 g/mol, XLogP of 3.83, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyloxy-N-ethyl-1-(2,4,6-trimethylphenyl)ethanamine is sourced from PubChem (CID 62116834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).