5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide

C12H16BrNO3 — CID 102632344

IUPAC5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide
SMILESCN(C(=O)c1ccc(Br)o1)C1CCCCC1O
InChIInChI=1S/C12H16BrNO3/c1-14(8-4-2-3-5-9(8)15)12(16)10-6-7-11(13)17-10/h6-9,15H,2-5H2,1H3
InChIKeyUGBNSNSKFUOFGM-UHFFFAOYSA-N
MW302.17 g/mol
LogP2.42
Rot. Bonds2

About 5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide

5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide (PubChem CID 102632344) has the molecular formula C12H16BrNO3 and a molecular weight of 302.17 g/mol. Its IUPAC name is 5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide
PubChem CID102632344
Molecular FormulaC12H16BrNO3
Molecular Weight302.17 g/mol
Exact Mass301.03
IUPAC Name5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide
SMILESCN(C(=O)c1ccc(Br)o1)C1CCCCC1O
InChIInChI=1S/C12H16BrNO3/c1-14(8-4-2-3-5-9(8)15)12(16)10-6-7-11(13)17-10/h6-9,15H,2-5H2,1H3
InChIKeyUGBNSNSKFUOFGM-UHFFFAOYSA-N
XLogP2.42
TPSA53.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.17
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-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

5-bromo-N-[(1R,2R)-2-fluorocyclopentyl]-N-methylfuran-2-carboxamide
CID 126856171
5-bromo-N-methyl-N-(4-methylcyclohexyl)furan-2-carboxamide
CID 55028576
5-bromo-N-[(3R,4S)-4-fluorooxolan-3-yl]-N-methylfuran-2-carboxamide
CID 126856207
5-bromo-N-methyl-N-piperidin-4-ylfuran-2-carboxamide
CID 43602151
5-chloro-N-(2-chlorocyclohexyl)-N-methylfuran-2-carboxamide
CID 106690219
N-(2-hydroxycyclohexyl)-N-methyl-1-benzofuran-2-carboxamide
CID 102635560
5-bromo-N-cyclopentyl-N-[2-(dimethylamino)ethyl]furan-2-carboxamide
CID 61343308
5-bromo-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)furan-2-carboxamide
CID 60725134
5-bromo-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methylfuran-2-carboxamide
CID 2337336
5-bromo-N-cyclopentyl-N-prop-2-enylfuran-2-carboxamide
CID 61062387
4-(2-aminoethyl)-N-(2-hydroxycyclohexyl)-N-methylbenzamide
CID 102631902
5-bromo-N-cyclopentyl-N-(2-methylpropyl)furan-2-carboxamide
CID 112725800

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide?
The IUPAC name of 5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide (CID 102632344) is 5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide?
The canonical SMILES for 5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide is CN(C(=O)c1ccc(Br)o1)C1CCCCC1O.
What is the InChIKey of 5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide?
The InChIKey is UGBNSNSKFUOFGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16BrNO3/c1-14(8-4-2-3-5-9(8)15)12(16)10-6-7-11(13)17-10/h6-9,15H,2-5H2,1H3.
What are the key properties of 5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide?
5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide has a molecular weight of 302.17 g/mol, XLogP of 2.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-hydroxycyclohexyl)-N-methylfuran-2-carboxamide is sourced from PubChem (CID 102632344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).