1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine

C16H24FNO — CID 106200053

IUPAC1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine
SMILESCCC(N)C(OCCC1CCC1)c1ccccc1F
InChIInChI=1S/C16H24FNO/c1-2-15(18)16(13-8-3-4-9-14(13)17)19-11-10-12-6-5-7-12/h3-4,8-9,12,15-16H,2,5-7,10-11,18H2,1H3
InChIKeyMYMNCUWKSTWQIV-UHFFFAOYSA-N
MW265.37 g/mol
LogP3.81
Rot. Bonds7

About 1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine

1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine (PubChem CID 106200053) has the molecular formula C16H24FNO and a molecular weight of 265.37 g/mol. Its IUPAC name is 1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine.

Molecular Properties

Compound Name1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine
PubChem CID106200053
Molecular FormulaC16H24FNO
Molecular Weight265.37 g/mol
Exact Mass265.18
IUPAC Name1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine
SMILESCCC(N)C(OCCC1CCC1)c1ccccc1F
InChIInChI=1S/C16H24FNO/c1-2-15(18)16(13-8-3-4-9-14(13)17)19-11-10-12-6-5-7-12/h3-4,8-9,12,15-16H,2,5-7,10-11,18H2,1H3
InChIKeyMYMNCUWKSTWQIV-UHFFFAOYSA-N
XLogP3.81
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.37
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,3-dimethylbutoxy)-1-(2-fluorophenyl)butan-2-amine
CID 66233120
1-cyclopentyloxy-1-(2-fluorophenyl)butan-2-amine
CID 55018597
1-(2-cyclobutylethoxy)-1-thiophen-2-ylbutan-2-amine
CID 106200095
1-(2-cyclobutylethoxy)-1-(4-methylphenyl)butan-2-amine
CID 106200131
1-(2-fluorophenyl)-1-[(2-fluorophenyl)methoxy]butan-2-amine
CID 63934055
1-(2-bromophenyl)-1-(2-cyclobutylethoxy)propan-2-amine
CID 106200055
1-(cyclohexylmethoxy)-1-(2-fluorophenyl)propan-2-amine
CID 62383305
2-(2-cyclobutylethoxy)-1-phenylbutan-1-amine
CID 106201059
1-N-(cyclopentylmethyl)-1-(2-fluorophenyl)-1-N-methylbutane-1,2-diamine
CID 63633108
2-(2-cyclopropylethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine
CID 114157889
1-(2-ethylbutoxy)-1-(2-fluorophenyl)propan-2-amine
CID 114208275
1-(2-cyclobutylethoxy)-1-pyridin-2-ylpropan-2-amine
CID 106200221

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine?
The IUPAC name of 1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine (CID 106200053) is 1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine.
What is the SMILES notation for 1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine?
The canonical SMILES for 1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine is CCC(N)C(OCCC1CCC1)c1ccccc1F.
What is the InChIKey of 1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine?
The InChIKey is MYMNCUWKSTWQIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO/c1-2-15(18)16(13-8-3-4-9-14(13)17)19-11-10-12-6-5-7-12/h3-4,8-9,12,15-16H,2,5-7,10-11,18H2,1H3.
What are the key properties of 1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine?
1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine has a molecular weight of 265.37 g/mol, XLogP of 3.81, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclobutylethoxy)-1-(2-fluorophenyl)butan-2-amine is sourced from PubChem (CID 106200053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).