N-(5-bromofuran-2-yl)oxymethanamine

C5H6BrNO2 — CID 117126735

IUPACN-(5-bromofuran-2-yl)oxymethanamine
SMILESCNOc1ccc(Br)o1
InChIInChI=1S/C5H6BrNO2/c1-7-9-5-3-2-4(6)8-5/h2-3,7H,1H3
InChIKeyLVGRHOBDOUNMHL-UHFFFAOYSA-N
MW192.01 g/mol
LogP1.56
Rot. Bonds2

About N-(5-bromofuran-2-yl)oxymethanamine

N-(5-bromofuran-2-yl)oxymethanamine (PubChem CID 117126735) has the molecular formula C5H6BrNO2 and a molecular weight of 192.01 g/mol. Its IUPAC name is N-(5-bromofuran-2-yl)oxymethanamine.

Molecular Properties

Compound NameN-(5-bromofuran-2-yl)oxymethanamine
PubChem CID117126735
Molecular FormulaC5H6BrNO2
Molecular Weight192.01 g/mol
Exact Mass190.96
IUPAC NameN-(5-bromofuran-2-yl)oxymethanamine
SMILESCNOc1ccc(Br)o1
InChIInChI=1S/C5H6BrNO2/c1-7-9-5-3-2-4(6)8-5/h2-3,7H,1H3
InChIKeyLVGRHOBDOUNMHL-UHFFFAOYSA-N
XLogP1.56
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.01
LogP ≤ 51.56
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

(5-bromofuran-2-yl) carbonochloridate
CID 87583331
N-[(5-bromofuran-2-yl)methoxy]methanamine
CID 117126797
1-(5-bromofuran-2-yl)-N-methylmethanamine
CID 16787243
N-[1-(5-bromofuran-2-yl)propyl]hydroxylamine
CID 130151575
O-[2-(5-bromofuran-2-yl)propan-2-yl]hydroxylamine
CID 117104833
tris(5-bromofuran-2-yl)phosphane
CID 10814161
1-(5-bromofuran-2-yl)ethyl acetate
CID 174586454
5-bromo-N-(2-chloro-3-methoxypropyl)furan-2-carboxamide
CID 114298680
2-(5-bromofuran-2-yl)propan-2-ol
CID 66520373
1-(5-bromofuran-2-yl)-2-methylprop-2-en-1-ol
CID 79189901
1-(5-bromofuran-2-yl)-1-(2-bromo-4-methoxyphenyl)-N-methylmethanamine
CID 60787977
1-(5-bromofuran-2-yl)-N,5-dimethylhexan-1-amine
CID 105028730

Frequently Asked Questions

What is the IUPAC name of N-(5-bromofuran-2-yl)oxymethanamine?
The IUPAC name of N-(5-bromofuran-2-yl)oxymethanamine (CID 117126735) is N-(5-bromofuran-2-yl)oxymethanamine.
What is the SMILES notation for N-(5-bromofuran-2-yl)oxymethanamine?
The canonical SMILES for N-(5-bromofuran-2-yl)oxymethanamine is CNOc1ccc(Br)o1.
What is the InChIKey of N-(5-bromofuran-2-yl)oxymethanamine?
The InChIKey is LVGRHOBDOUNMHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6BrNO2/c1-7-9-5-3-2-4(6)8-5/h2-3,7H,1H3.
What are the key properties of N-(5-bromofuran-2-yl)oxymethanamine?
N-(5-bromofuran-2-yl)oxymethanamine has a molecular weight of 192.01 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromofuran-2-yl)oxymethanamine is sourced from PubChem (CID 117126735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).