2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide

C11H15BrN2O2 — CID 106855036

IUPAC2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide
SMILESCN(C(=O)c1ccoc1Br)C1CCNCC1
InChIInChI=1S/C11H15BrN2O2/c1-14(8-2-5-13-6-3-8)11(15)9-4-7-16-10(9)12/h4,7-8,13H,2-3,5-6H2,1H3
InChIKeyLOYNGPCCDYFDBD-UHFFFAOYSA-N
MW287.16 g/mol
LogP1.87
Rot. Bonds2

About 2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide

2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide (PubChem CID 106855036) has the molecular formula C11H15BrN2O2 and a molecular weight of 287.16 g/mol. Its IUPAC name is 2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide.

Molecular Properties

Compound Name2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide
PubChem CID106855036
Molecular FormulaC11H15BrN2O2
Molecular Weight287.16 g/mol
Exact Mass286.03
IUPAC Name2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide
SMILESCN(C(=O)c1ccoc1Br)C1CCNCC1
InChIInChI=1S/C11H15BrN2O2/c1-14(8-2-5-13-6-3-8)11(15)9-4-7-16-10(9)12/h4,7-8,13H,2-3,5-6H2,1H3
InChIKeyLOYNGPCCDYFDBD-UHFFFAOYSA-N
XLogP1.87
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.16
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-methyl-N-piperidin-4-ylfuran-3-carboxamide
CID 106688438
2-bromo-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)furan-3-carboxamide
CID 106853405
5-bromo-N-methyl-N-piperidin-4-ylfuran-2-carboxamide
CID 43602151
5-bromo-N-methyl-N-piperidin-4-ylthiophene-2-carboxamide
CID 43602032
2-bromo-5-fluoro-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119444450
N-(azepan-4-yl)-3-bromo-N,2-dimethylbenzamide
CID 104974738
3,5-dibromo-N-methyl-N-piperidin-4-ylbenzamide
CID 114022754
2,3,4-trifluoro-N-methyl-N-piperidin-4-ylbenzamide
CID 79750025
4-[(2-bromofuran-3-carbonyl)-methylamino]oxolane-3-carboxylic acid
CID 106851090
N-(azepan-4-yl)-4-bromo-N,2-dimethylbenzamide
CID 104974736
2-bromo-N-cyclopropyl-N-prop-2-enylfuran-3-carboxamide
CID 106854213
N-(azepan-4-yl)-4-bromo-N-methylbenzamide
CID 104974446

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide?
The IUPAC name of 2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide (CID 106855036) is 2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide.
What is the SMILES notation for 2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide?
The canonical SMILES for 2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide is CN(C(=O)c1ccoc1Br)C1CCNCC1.
What is the InChIKey of 2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide?
The InChIKey is LOYNGPCCDYFDBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O2/c1-14(8-2-5-13-6-3-8)11(15)9-4-7-16-10(9)12/h4,7-8,13H,2-3,5-6H2,1H3.
What are the key properties of 2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide?
2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide has a molecular weight of 287.16 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-methyl-N-piperidin-4-ylfuran-3-carboxamide is sourced from PubChem (CID 106855036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).