2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide

C10H14BrNO3 — CID 106854337

IUPAC2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide
SMILESCN(C(=O)c1ccoc1Br)C(C)(C)CO
InChIInChI=1S/C10H14BrNO3/c1-10(2,6-13)12(3)9(14)7-4-5-15-8(7)11/h4-5,13H,6H2,1-3H3
InChIKeyRUYDUFYTIIIYPK-UHFFFAOYSA-N
MW276.13 g/mol
LogP1.88
Rot. Bonds3

About 2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide

2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide (PubChem CID 106854337) has the molecular formula C10H14BrNO3 and a molecular weight of 276.13 g/mol. Its IUPAC name is 2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide.

Molecular Properties

Compound Name2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide
PubChem CID106854337
Molecular FormulaC10H14BrNO3
Molecular Weight276.13 g/mol
Exact Mass275.02
IUPAC Name2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide
SMILESCN(C(=O)c1ccoc1Br)C(C)(C)CO
InChIInChI=1S/C10H14BrNO3/c1-10(2,6-13)12(3)9(14)7-4-5-15-8(7)11/h4-5,13H,6H2,1-3H3
InChIKeyRUYDUFYTIIIYPK-UHFFFAOYSA-N
XLogP1.88
TPSA53.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.13
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-bromo-N-(3-bromopropyl)-N-methylfuran-3-carboxamide
CID 106441118
2-bromo-N-ethyl-N-(2-hydroxy-2-methylpropyl)furan-3-carboxamide
CID 106854125
2-bromo-N-(3-hydroxy-2,2-dimethylpropyl)furan-3-carboxamide
CID 106854194
3-hydroxy-N-(1-hydroxy-2-methylpropan-2-yl)-N,2-dimethylbenzamide
CID 113475336
2-bromo-4-chloro-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylbenzamide
CID 107988364
2-bromo-N-cyano-N-methylfuran-3-carboxamide
CID 130615092
2-bromo-N-(cyanomethyl)-N-methylfuran-3-carboxamide
CID 106852111
2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-N,5-dimethylbenzamide
CID 113475389
2-bromo-N-(4-ethylphenyl)-N-methylfuran-3-carboxamide
CID 106853847
2-bromo-N-methyl-N-(pyridin-4-ylmethyl)furan-3-carboxamide
CID 106852639
N-[(3Z)-3-amino-3-hydroxyimino-2-methylpropyl]-2-bromo-N-methylfuran-3-carboxamide
CID 106855764
1-(2-bromofuran-3-yl)-3-methylbutan-1-one
CID 106856556

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide?
The IUPAC name of 2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide (CID 106854337) is 2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide.
What is the SMILES notation for 2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide?
The canonical SMILES for 2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide is CN(C(=O)c1ccoc1Br)C(C)(C)CO.
What is the InChIKey of 2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide?
The InChIKey is RUYDUFYTIIIYPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrNO3/c1-10(2,6-13)12(3)9(14)7-4-5-15-8(7)11/h4-5,13H,6H2,1-3H3.
What are the key properties of 2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide?
2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide has a molecular weight of 276.13 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylfuran-3-carboxamide is sourced from PubChem (CID 106854337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).