2-[(5-bromofuran-2-yl)methylamino]acetamide

C7H9BrN2O2 — CID 16790036

IUPAC2-[(5-bromofuran-2-yl)methylamino]acetamide
SMILESNC(=O)CNCc1ccc(Br)o1
InChIInChI=1S/C7H9BrN2O2/c8-6-2-1-5(12-6)3-10-4-7(9)11/h1-2,10H,3-4H2,(H2,9,11)
InChIKeyGVANWEMSLYFKAH-UHFFFAOYSA-N
MW233.06 g/mol
LogP0.62
Rot. Bonds4

About 2-[(5-bromofuran-2-yl)methylamino]acetamide

2-[(5-bromofuran-2-yl)methylamino]acetamide (PubChem CID 16790036) has the molecular formula C7H9BrN2O2 and a molecular weight of 233.06 g/mol. Its IUPAC name is 2-[(5-bromofuran-2-yl)methylamino]acetamide.

Molecular Properties

Compound Name2-[(5-bromofuran-2-yl)methylamino]acetamide
PubChem CID16790036
Molecular FormulaC7H9BrN2O2
Molecular Weight233.06 g/mol
Exact Mass231.98
IUPAC Name2-[(5-bromofuran-2-yl)methylamino]acetamide
SMILESNC(=O)CNCc1ccc(Br)o1
InChIInChI=1S/C7H9BrN2O2/c8-6-2-1-5(12-6)3-10-4-7(9)11/h1-2,10H,3-4H2,(H2,9,11)
InChIKeyGVANWEMSLYFKAH-UHFFFAOYSA-N
XLogP0.62
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.06
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4,5-dibromofuran-2-yl)methylamino]acetamide
CID 62083921
N-[(5-bromofuran-2-yl)methyl]-2-chloroprop-2-en-1-amine
CID 115745349
2-[(5-bromofuran-2-yl)methylamino]-1-pyrrolidin-1-ylethanone
CID 115745353
N-benzyl-2-[(5-bromofuran-2-yl)methylamino]acetamide
CID 54881657
2-[(5-bromofuran-2-yl)methylamino]-2-oxoacetic acid
CID 131209047
3-[(5-bromofuran-2-yl)methylamino]-N,N-dimethylpropanamide
CID 60926484
2-(5-bromofuran-2-yl)ethylurea
CID 131153537
2-(1,2-oxazol-5-ylmethylamino)acetamide
CID 103605544
3-[(5-bromofuran-2-yl)methylamino]-2,2,3-trimethylbutanoic acid
CID 65265100
N-[(5-bromofuran-2-yl)methyl]-1-cyclohexylmethanamine
CID 43215825
1-(5-bromofuran-2-yl)-N-methylmethanamine
CID 16787243
1-benzyl-3-[(5-bromofuran-2-yl)methyl]urea
CID 131219763

Frequently Asked Questions

What is the IUPAC name of 2-[(5-bromofuran-2-yl)methylamino]acetamide?
The IUPAC name of 2-[(5-bromofuran-2-yl)methylamino]acetamide (CID 16790036) is 2-[(5-bromofuran-2-yl)methylamino]acetamide.
What is the SMILES notation for 2-[(5-bromofuran-2-yl)methylamino]acetamide?
The canonical SMILES for 2-[(5-bromofuran-2-yl)methylamino]acetamide is NC(=O)CNCc1ccc(Br)o1.
What is the InChIKey of 2-[(5-bromofuran-2-yl)methylamino]acetamide?
The InChIKey is GVANWEMSLYFKAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9BrN2O2/c8-6-2-1-5(12-6)3-10-4-7(9)11/h1-2,10H,3-4H2,(H2,9,11).
What are the key properties of 2-[(5-bromofuran-2-yl)methylamino]acetamide?
2-[(5-bromofuran-2-yl)methylamino]acetamide has a molecular weight of 233.06 g/mol, XLogP of 0.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-bromofuran-2-yl)methylamino]acetamide is sourced from PubChem (CID 16790036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).