2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine

C14H20BrNO — CID 106200075

IUPAC2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine
SMILESNCC(OCCC1CCC1)c1ccc(Br)cc1
InChIInChI=1S/C14H20BrNO/c15-13-6-4-12(5-7-13)14(10-16)17-9-8-11-2-1-3-11/h4-7,11,14H,1-3,8-10,16H2
InChIKeyQEGGLRBPADXTCW-UHFFFAOYSA-N
MW298.22 g/mol
LogP3.66
Rot. Bonds6

About 2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine

2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine (PubChem CID 106200075) has the molecular formula C14H20BrNO and a molecular weight of 298.22 g/mol. Its IUPAC name is 2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine.

Molecular Properties

Compound Name2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine
PubChem CID106200075
Molecular FormulaC14H20BrNO
Molecular Weight298.22 g/mol
Exact Mass297.07
IUPAC Name2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine
SMILESNCC(OCCC1CCC1)c1ccc(Br)cc1
InChIInChI=1S/C14H20BrNO/c15-13-6-4-12(5-7-13)14(10-16)17-9-8-11-2-1-3-11/h4-7,11,14H,1-3,8-10,16H2
InChIKeyQEGGLRBPADXTCW-UHFFFAOYSA-N
XLogP3.66
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.22
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine
CID 106200135
2-(4-bromophenyl)-2-(2-cyclobutylethoxy)-N-ethylethanamine
CID 106205111
1-bromo-4-[1-(2-cyclobutylethoxy)ethyl]benzene
CID 166785433
2-(2-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine
CID 114157313
N-[2-(4-bromophenyl)-2-(2-cyclopropylethoxy)ethyl]propan-2-amine
CID 106204893
N-[2-(4-bromophenyl)-2-(2-cyclopropylethoxy)ethyl]cyclopropanamine
CID 106204912
2-(4-bromophenyl)-2-(2-cyclopropylethoxy)-N-methylethanamine
CID 106204927
2-(2-cyclobutylethoxy)-2-pyridin-3-ylethanamine
CID 106200033
2-(4-bromophenyl)-2-heptoxyethanamine
CID 63459731
1-bromo-3-[1-(2-cyclobutylethoxy)-2-iodoethyl]benzene
CID 106204833
1-bromo-4-[1-(cyclopentylmethoxy)-2-iodoethyl]benzene
CID 114774613
2-(4-bromophenyl)-2-(3-methylcyclohexyl)oxyethanamine
CID 55015654

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine?
The IUPAC name of 2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine (CID 106200075) is 2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine.
What is the SMILES notation for 2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine?
The canonical SMILES for 2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine is NCC(OCCC1CCC1)c1ccc(Br)cc1.
What is the InChIKey of 2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine?
The InChIKey is QEGGLRBPADXTCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20BrNO/c15-13-6-4-12(5-7-13)14(10-16)17-9-8-11-2-1-3-11/h4-7,11,14H,1-3,8-10,16H2.
What are the key properties of 2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine?
2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine has a molecular weight of 298.22 g/mol, XLogP of 3.66, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-2-(2-cyclobutylethoxy)ethanamine is sourced from PubChem (CID 106200075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).