N-[1-(5-bromofuran-2-yl)propyl]hydroxylamine

C7H10BrNO2 — CID 130151575

IUPACN-[1-(5-bromofuran-2-yl)propyl]hydroxylamine
SMILESCCC(NO)c1ccc(Br)o1
InChIInChI=1S/C7H10BrNO2/c1-2-5(9-10)6-3-4-7(8)11-6/h3-5,9-10H,2H2,1H3
InChIKeyJMDZNDROYVDXAC-UHFFFAOYSA-N
MW220.07 g/mol
LogP2.47
Rot. Bonds3

About N-[1-(5-bromofuran-2-yl)propyl]hydroxylamine

N-[1-(5-bromofuran-2-yl)propyl]hydroxylamine (PubChem CID 130151575) has the molecular formula C7H10BrNO2 and a molecular weight of 220.07 g/mol. Its IUPAC name is N-[1-(5-bromofuran-2-yl)propyl]hydroxylamine.

Molecular Properties

Compound NameN-[1-(5-bromofuran-2-yl)propyl]hydroxylamine
PubChem CID130151575
Molecular FormulaC7H10BrNO2
Molecular Weight220.07 g/mol
Exact Mass218.99
IUPAC NameN-[1-(5-bromofuran-2-yl)propyl]hydroxylamine
SMILESCCC(NO)c1ccc(Br)o1
InChIInChI=1S/C7H10BrNO2/c1-2-5(9-10)6-3-4-7(8)11-6/h3-5,9-10H,2H2,1H3
InChIKeyJMDZNDROYVDXAC-UHFFFAOYSA-N
XLogP2.47
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.07
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-ethylethanamine
CID 61064969
N-[1-(5-bromofuran-2-yl)ethyl]-1-(4-methylphenyl)propan-1-amine
CID 104652485
1-(5-bromofuran-2-yl)hexylhydrazine
CID 105294743
(2S)-2-[1-(5-bromofuran-2-yl)ethylamino]butan-1-ol
CID 104980490
1-(5-bromofuran-2-yl)-2-(3,5-difluorophenyl)-N-ethylethanamine
CID 105412461
N-[1-(5-bromofuran-2-yl)-2-ethoxyethyl]propan-1-amine
CID 105007868
1-(5-bromofuran-2-yl)-N,5-dimethylhexan-1-amine
CID 105028730
1-(5-bromofuran-2-yl)-N-ethyl-2-naphthalen-1-ylethanamine
CID 63527036
N-[1-(5-bromofuran-2-yl)-2-(3,5-difluorophenyl)ethyl]propan-1-amine
CID 105412533
1-(5-bromofuran-2-yl)-N-ethyl-2-(3-methylphenyl)ethanamine
CID 55067944
N-[1-(5-bromofuran-2-yl)ethyl]-2-methylprop-2-en-1-amine
CID 114615383
1-(5-bromofuran-2-yl)-2-(4-bromophenyl)-N-methylethanamine
CID 61066395

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-bromofuran-2-yl)propyl]hydroxylamine?
The IUPAC name of N-[1-(5-bromofuran-2-yl)propyl]hydroxylamine (CID 130151575) is N-[1-(5-bromofuran-2-yl)propyl]hydroxylamine.
What is the SMILES notation for N-[1-(5-bromofuran-2-yl)propyl]hydroxylamine?
The canonical SMILES for N-[1-(5-bromofuran-2-yl)propyl]hydroxylamine is CCC(NO)c1ccc(Br)o1.
What is the InChIKey of N-[1-(5-bromofuran-2-yl)propyl]hydroxylamine?
The InChIKey is JMDZNDROYVDXAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10BrNO2/c1-2-5(9-10)6-3-4-7(8)11-6/h3-5,9-10H,2H2,1H3.
What are the key properties of N-[1-(5-bromofuran-2-yl)propyl]hydroxylamine?
N-[1-(5-bromofuran-2-yl)propyl]hydroxylamine has a molecular weight of 220.07 g/mol, XLogP of 2.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-bromofuran-2-yl)propyl]hydroxylamine is sourced from PubChem (CID 130151575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).