5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide

C14H14BrNO2 — CID 2987008

IUPAC5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide
SMILESO=C(NC1CCCC1)c1cc2cc(Br)ccc2o1
InChIInChI=1S/C14H14BrNO2/c15-10-5-6-12-9(7-10)8-13(18-12)14(17)16-11-3-1-2-4-11/h5-8,11H,1-4H2,(H,16,17)
InChIKeyVWBXMKQEYKPMON-UHFFFAOYSA-N
MW308.18 g/mol
LogP3.87
Rot. Bonds2

About 5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide

5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide (PubChem CID 2987008) has the molecular formula C14H14BrNO2 and a molecular weight of 308.18 g/mol. Its IUPAC name is 5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide
PubChem CID2987008
Molecular FormulaC14H14BrNO2
Molecular Weight308.18 g/mol
Exact Mass307.02
IUPAC Name5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide
SMILESO=C(NC1CCCC1)c1cc2cc(Br)ccc2o1
InChIInChI=1S/C14H14BrNO2/c15-10-5-6-12-9(7-10)8-13(18-12)14(17)16-11-3-1-2-4-11/h5-8,11H,1-4H2,(H,16,17)
InChIKeyVWBXMKQEYKPMON-UHFFFAOYSA-N
XLogP3.87
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.18
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-bromo-N-cyclopentyl-1-benzofuran-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

CL82198
CID 2777
N-(1-phenylethyl)-1-benzofuran-2-carboxamide
CID 2788390
5-bromo-N-[[4-(propylaminocarbamoyl)phenyl]methyl]-1-benzofuran-2-carboxamide
CID 166627468
Benzofuran-2-yl(pyrrolidin-1-yl)methanone
CID 977385
2-Benzofurancarboxamide, N-methyl-
CID 660372
N-cyclopropyl-1-benzofuran-2-carboxamide
CID 894902
N-[(2-methoxyphenyl)methyl]-1-benzofuran-2-carboxamide
CID 2469681
N-[(4-fluorophenyl)methyl]-1-benzofuran-2-carboxamide
CID 2668546
5-bromo-N-cyclohexyl-1-benzofuran-2-carboxamide
CID 2991779
N-cyclopentyl-3-methyl-1-benzofuran-2-carboxamide
CID 9078207
Azetidin-1-yl-(5-bromo-3-methyl-1-benzofuran-2-yl)methanone
CID 9360455
3-methyl-N-(4-methylcyclohexyl)-1-benzofuran-2-carboxamide
CID 17173009

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide?
The IUPAC name of 5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide (CID 2987008) is 5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide.
What is the SMILES notation for 5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide?
The canonical SMILES for 5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide is O=C(NC1CCCC1)c1cc2cc(Br)ccc2o1.
What is the InChIKey of 5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide?
The InChIKey is VWBXMKQEYKPMON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrNO2/c15-10-5-6-12-9(7-10)8-13(18-12)14(17)16-11-3-1-2-4-11/h5-8,11H,1-4H2,(H,16,17).
What are the key properties of 5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide?
5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide has a molecular weight of 308.18 g/mol, XLogP of 3.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-cyclopentyl-1-benzofuran-2-carboxamide is sourced from PubChem (CID 2987008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).