N-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide

C10H9BrClNO2 — CID 146108306

IUPACN-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide
SMILESO=C(CCl)Nc1c(Br)ccc2c1CCO2
InChIInChI=1S/C10H9BrClNO2/c11-7-1-2-8-6(3-4-15-8)10(7)13-9(14)5-12/h1-2H,3-5H2,(H,13,14)
InChIKeyGLQMIWIBDKPAQB-UHFFFAOYSA-N
MW290.54 g/mol
LogP2.56
Rot. Bonds2

About N-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide

N-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide (PubChem CID 146108306) has the molecular formula C10H9BrClNO2 and a molecular weight of 290.54 g/mol. Its IUPAC name is N-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide.

Molecular Properties

Compound NameN-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide
PubChem CID146108306
Molecular FormulaC10H9BrClNO2
Molecular Weight290.54 g/mol
Exact Mass288.95
IUPAC NameN-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide
SMILESO=C(CCl)Nc1c(Br)ccc2c1CCO2
InChIInChI=1S/C10H9BrClNO2/c11-7-1-2-8-6(3-4-15-8)10(7)13-9(14)5-12/h1-2H,3-5H2,(H,13,14)
InChIKeyGLQMIWIBDKPAQB-UHFFFAOYSA-N
XLogP2.56
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.54
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-(2,3-dihydro-1-benzofuran-5-yl)acetamide
CID 43701447
5-bromo-4-chloro-2,3-dihydro-1-benzofuran
CID 82374686
N-(5-chloro-2,3-dihydro-1-benzofuran-4-yl)acetamide
CID 151540497
1-(5-chloro-2,3-dihydro-1-benzofuran-4-yl)-2-(methylamino)ethanone
CID 117324410
2-chloro-N-[(4-methyl-2,3-dihydro-1-benzofuran-7-yl)carbamoyl]acetamide
CID 175550824
N-[(4S)-6-bromo-3,4-dihydro-2H-chromen-4-yl]-2-chloroacetamide
CID 167888581
2-chloro-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopropyl]acetamide
CID 146106549
2-chloro-N-(5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)acetamide
CID 166415004
[2-[(5-bromo-1,3-benzodioxol-4-yl)amino]-2-oxoethyl]-diethylazanium
CID 4261852
N-(5,7-dibromo-2,3-dihydro-1-benzofuran-4-yl)acetamide;pentane
CID 144855943
tert-butyl N-(6-bromo-2,3-dihydro-1,4-benzodioxin-5-yl)carbamate
CID 178072489
3-amino-4-bromo-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide
CID 61095483

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide?
The IUPAC name of N-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide (CID 146108306) is N-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide.
What is the SMILES notation for N-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide?
The canonical SMILES for N-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide is O=C(CCl)Nc1c(Br)ccc2c1CCO2.
What is the InChIKey of N-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide?
The InChIKey is GLQMIWIBDKPAQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrClNO2/c11-7-1-2-8-6(3-4-15-8)10(7)13-9(14)5-12/h1-2H,3-5H2,(H,13,14).
What are the key properties of N-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide?
N-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide has a molecular weight of 290.54 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2,3-dihydro-1-benzofuran-4-yl)-2-chloroacetamide is sourced from PubChem (CID 146108306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).