7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide

C17H14BrNO2 — CID 38925942

IUPAC7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide
SMILESCCN(C(=O)c1cc2cccc(Br)c2o1)c1ccccc1
InChIInChI=1S/C17H14BrNO2/c1-2-19(13-8-4-3-5-9-13)17(20)15-11-12-7-6-10-14(18)16(12)21-15/h3-11H,2H2,1H3
InChIKeyVRBPWMTYNMNNFC-UHFFFAOYSA-N
MW344.21 g/mol
LogP4.86
Rot. Bonds3

About 7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide

7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide (PubChem CID 38925942) has the molecular formula C17H14BrNO2 and a molecular weight of 344.21 g/mol. Its IUPAC name is 7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide
PubChem CID38925942
Molecular FormulaC17H14BrNO2
Molecular Weight344.21 g/mol
Exact Mass343.02
IUPAC Name7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide
SMILESCCN(C(=O)c1cc2cccc(Br)c2o1)c1ccccc1
InChIInChI=1S/C17H14BrNO2/c1-2-19(13-8-4-3-5-9-13)17(20)15-11-12-7-6-10-14(18)16(12)21-15/h3-11H,2H2,1H3
InChIKeyVRBPWMTYNMNNFC-UHFFFAOYSA-N
XLogP4.86
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.21
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(azetidin-3-yl)-7-bromo-N-ethyl-1-benzofuran-2-carboxamide
CID 66181896
7-bromo-N-(2-hydroxyethyl)-N-methyl-1-benzofuran-2-carboxamide
CID 110890190
N-(2-anilino-2-oxoethyl)-7-bromo-N-methyl-1-benzofuran-2-carboxamide
CID 46460862
N-benzyl-7-bromo-1-benzofuran-2-carboxamide
CID 38885383
7-bromo-N-methyl-N-[(2-methylphenyl)methyl]-1-benzofuran-2-carboxamide
CID 39717319
7-bromo-N-[(4-chlorophenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide
CID 55684638
N-(azetidin-3-yl)-7-bromo-N-propyl-1-benzofuran-2-carboxamide
CID 66213648
2,5-dibromo-N-ethyl-N-phenylbenzamide
CID 53352174
7-bromo-1-benzofuran-2-carboxamide
CID 47331810
N-(3-amino-2,2-dimethylpropyl)-7-bromo-N-methyl-1-benzofuran-2-carboxamide
CID 79652409
7-bromo-N-[2-(propylamino)ethyl]-1-benzofuran-2-carboxamide
CID 55100770
N-ethyl-5-methyl-N-phenylfuro[3,2-b]pyridine-2-carboxamide
CID 16906958

Frequently Asked Questions

What is the IUPAC name of 7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide?
The IUPAC name of 7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide (CID 38925942) is 7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide.
What is the SMILES notation for 7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide?
The canonical SMILES for 7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide is CCN(C(=O)c1cc2cccc(Br)c2o1)c1ccccc1.
What is the InChIKey of 7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide?
The InChIKey is VRBPWMTYNMNNFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14BrNO2/c1-2-19(13-8-4-3-5-9-13)17(20)15-11-12-7-6-10-14(18)16(12)21-15/h3-11H,2H2,1H3.
What are the key properties of 7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide?
7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide has a molecular weight of 344.21 g/mol, XLogP of 4.86, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-N-ethyl-N-phenyl-1-benzofuran-2-carboxamide is sourced from PubChem (CID 38925942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).