N-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine

C10H14BrNO — CID 104652955

IUPACN-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine
SMILESCC(NC1CCC1)c1ccc(Br)o1
InChIInChI=1S/C10H14BrNO/c1-7(12-8-3-2-4-8)9-5-6-10(11)13-9/h5-8,12H,2-4H2,1H3
InChIKeyYDDCAGWNCKTLKP-UHFFFAOYSA-N
MW244.13 g/mol
LogP3.25
Rot. Bonds3

About N-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine

N-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine (PubChem CID 104652955) has the molecular formula C10H14BrNO and a molecular weight of 244.13 g/mol. Its IUPAC name is N-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine.

Molecular Properties

Compound NameN-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine
PubChem CID104652955
Molecular FormulaC10H14BrNO
Molecular Weight244.13 g/mol
Exact Mass243.03
IUPAC NameN-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine
SMILESCC(NC1CCC1)c1ccc(Br)o1
InChIInChI=1S/C10H14BrNO/c1-7(12-8-3-2-4-8)9-5-6-10(11)13-9/h5-8,12H,2-4H2,1H3
InChIKeyYDDCAGWNCKTLKP-UHFFFAOYSA-N
XLogP3.25
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.13
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[1-(5-bromofuran-2-yl)ethylamino]cyclohexane-1-carboxylic acid
CID 113437711
N-[1-(5-bromofuran-2-yl)ethyl]-1,1-dioxothiolan-3-amine
CID 104651994
N-[1-(5-bromofuran-2-yl)ethyl]-1-pyrimidin-2-ylpiperidin-3-amine
CID 104652579
N-[1-(5-methylfuran-2-yl)ethyl]cyclopentanamine
CID 43177408
tert-butyl 4-[1-(5-bromofuran-2-yl)ethylamino]azepane-1-carboxylate
CID 107094045
N-[1-(5-bromofuran-2-yl)ethyl]cyclopent-2-en-1-amine
CID 164654731
N-[1-(5-bromofuran-2-yl)ethyl]adamantan-2-amine
CID 104652520
N-[1-(5-bromofuran-2-yl)ethyl]-2,4-dimethylcyclohexan-1-amine
CID 113437556
N-[1-(5-methylfuran-2-yl)ethyl]-3-propan-2-ylcyclohexan-1-amine
CID 107448054
1-benzyl-N-[1-(5-bromofuran-2-yl)ethyl]pyrrolidin-3-amine
CID 104652483
N-[1-(5-bromofuran-2-yl)ethyl]-N'-cyclopentyl-N'-methylethane-1,2-diamine
CID 104653000
2-[[1-(5-bromofuran-2-yl)ethylamino]methyl]cyclohexan-1-ol
CID 113437563

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine?
The IUPAC name of N-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine (CID 104652955) is N-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine.
What is the SMILES notation for N-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine?
The canonical SMILES for N-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine is CC(NC1CCC1)c1ccc(Br)o1.
What is the InChIKey of N-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine?
The InChIKey is YDDCAGWNCKTLKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrNO/c1-7(12-8-3-2-4-8)9-5-6-10(11)13-9/h5-8,12H,2-4H2,1H3.
What are the key properties of N-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine?
N-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine has a molecular weight of 244.13 g/mol, XLogP of 3.25, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-bromofuran-2-yl)ethyl]cyclobutanamine is sourced from PubChem (CID 104652955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).