3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine

C18H19BrFN — CID 43633263

IUPAC3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine
SMILESFc1ccccc1CCNC1CC(c2ccccc2Br)C1
InChIInChI=1S/C18H19BrFN/c19-17-7-3-2-6-16(17)14-11-15(12-14)21-10-9-13-5-1-4-8-18(13)20/h1-8,14-15,21H,9-12H2
InChIKeyZDAQHGOXWSYZMO-UHFFFAOYSA-N
MW348.26 g/mol
LogP4.67
Rot. Bonds5

About 3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine

3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine (PubChem CID 43633263) has the molecular formula C18H19BrFN and a molecular weight of 348.26 g/mol. Its IUPAC name is 3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine.

Molecular Properties

Compound Name3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine
PubChem CID43633263
Molecular FormulaC18H19BrFN
Molecular Weight348.26 g/mol
Exact Mass347.07
IUPAC Name3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine
SMILESFc1ccccc1CCNC1CC(c2ccccc2Br)C1
InChIInChI=1S/C18H19BrFN/c19-17-7-3-2-6-16(17)14-11-15(12-14)21-10-9-13-5-1-4-8-18(13)20/h1-8,14-15,21H,9-12H2
InChIKeyZDAQHGOXWSYZMO-UHFFFAOYSA-N
XLogP4.67
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.26
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(2-bromophenyl)-N-(2-thiophen-2-ylethyl)cyclobutan-1-amine
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3-(2-bromophenyl)-N-(4,4,4-trifluorobutyl)cyclobutan-1-amine
CID 115516190
3-(2-bromophenyl)-N-[2-(5-chlorothiophen-2-yl)ethyl]cyclobutan-1-amine
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CID 107849622
1-[[3-(2-bromophenyl)cyclobutyl]amino]pentan-3-ol
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3-(2-bromophenyl)-N-(3-propoxypropyl)cyclobutan-1-amine
CID 82940585
3-(2-bromophenyl)-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]cyclobutan-1-amine
CID 80681078
3-(2-bromophenyl)-N-(3-cyclopentylpropyl)cyclobutan-1-amine
CID 106009029
3-(2-bromophenyl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]cyclobutan-1-amine
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1-bromo-2-(3-fluorocyclobutyl)benzene
CID 115036967
3-(2-fluorophenyl)-N-[2-(3-fluorophenyl)ethyl]cyclobutan-1-amine
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Frequently Asked Questions

What is the IUPAC name of 3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine?
The IUPAC name of 3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine (CID 43633263) is 3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine.
What is the SMILES notation for 3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine?
The canonical SMILES for 3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine is Fc1ccccc1CCNC1CC(c2ccccc2Br)C1.
What is the InChIKey of 3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine?
The InChIKey is ZDAQHGOXWSYZMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19BrFN/c19-17-7-3-2-6-16(17)14-11-15(12-14)21-10-9-13-5-1-4-8-18(13)20/h1-8,14-15,21H,9-12H2.
What are the key properties of 3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine?
3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine has a molecular weight of 348.26 g/mol, XLogP of 4.67, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine is sourced from PubChem (CID 43633263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).