O-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine

C7H10BrNO2 — CID 117104833

IUPACO-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine
SMILESCC(C)(ON)c1ccc(Br)o1
InChIInChI=1S/C7H10BrNO2/c1-7(2,11-9)5-3-4-6(8)10-5/h3-4H,9H2,1-2H3
InChIKeyPMLCDPRQDKUOSC-UHFFFAOYSA-N
MW220.07 g/mol
LogP2.17
Rot. Bonds2

About O-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine

O-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine (PubChem CID 117104833) has the molecular formula C7H10BrNO2 and a molecular weight of 220.07 g/mol. Its IUPAC name is O-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine.

Molecular Properties

Compound NameO-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine
PubChem CID117104833
Molecular FormulaC7H10BrNO2
Molecular Weight220.07 g/mol
Exact Mass218.99
IUPAC NameO-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine
SMILESCC(C)(ON)c1ccc(Br)o1
InChIInChI=1S/C7H10BrNO2/c1-7(2,11-9)5-3-4-6(8)10-5/h3-4H,9H2,1-2H3
InChIKeyPMLCDPRQDKUOSC-UHFFFAOYSA-N
XLogP2.17
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.07
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(5-bromofuran-2-yl)propan-2-ol
CID 66520373
methyl 3-(5-bromofuran-2-yl)-3-hydroxy-2-methylbutanoate
CID 104653955
amino-(5-bromofuran-2-yl)-chloromethanol
CID 174473752
2-(5-bromofuran-2-yl)-2-(cyclopropylmethylamino)propanamide
CID 104653364
2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide
CID 104653342
2-(5-bromofuran-2-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
CID 104653465
ethyl 2-anilino-2-(5-bromofuran-2-yl)propanoate
CID 104653374
2-(5-bromofuran-2-yl)-2-(butan-2-ylamino)propan-1-ol
CID 104653909
methyl 2-(5-bromofuran-2-yl)-2-(4-methylanilino)propanoate
CID 104653371
2-(5-bromofuran-2-yl)-2-(2,2,2-trifluoroethylamino)propanamide
CID 104653438
1-(5-bromofuran-2-yl)-2-methylpropan-2-amine
CID 82661256
ethyl 2-(5-bromofuran-2-yl)-2-(cyclopentylamino)propanoate
CID 113437629

Frequently Asked Questions

What is the IUPAC name of O-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine?
The IUPAC name of O-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine (CID 117104833) is O-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine.
What is the SMILES notation for O-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine?
The canonical SMILES for O-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine is CC(C)(ON)c1ccc(Br)o1.
What is the InChIKey of O-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine?
The InChIKey is PMLCDPRQDKUOSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10BrNO2/c1-7(2,11-9)5-3-4-6(8)10-5/h3-4H,9H2,1-2H3.
What are the key properties of O-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine?
O-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine has a molecular weight of 220.07 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine is sourced from PubChem (CID 117104833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).