2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide

C11H6BrCl2NO2 — CID 106852540

IUPAC2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide
SMILESO=C(Nc1cccc(Cl)c1Cl)c1ccoc1Br
InChIInChI=1S/C11H6BrCl2NO2/c12-10-6(4-5-17-10)11(16)15-8-3-1-2-7(13)9(8)14/h1-5H,(H,15,16)
InChIKeyFSQYOEIELGEUPN-UHFFFAOYSA-N
MW334.98 g/mol
LogP4.60
Rot. Bonds2

About 2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide

2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide (PubChem CID 106852540) has the molecular formula C11H6BrCl2NO2 and a molecular weight of 334.98 g/mol. Its IUPAC name is 2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide.

Molecular Properties

Compound Name2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide
PubChem CID106852540
Molecular FormulaC11H6BrCl2NO2
Molecular Weight334.98 g/mol
Exact Mass332.90
IUPAC Name2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide
SMILESO=C(Nc1cccc(Cl)c1Cl)c1ccoc1Br
InChIInChI=1S/C11H6BrCl2NO2/c12-10-6(4-5-17-10)11(16)15-8-3-1-2-7(13)9(8)14/h1-5H,(H,15,16)
InChIKeyFSQYOEIELGEUPN-UHFFFAOYSA-N
XLogP4.60
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.98
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-N-(2-iodophenyl)furan-3-carboxamide
CID 106852274
2-bromo-N-(2-bromophenyl)furan-3-carboxamide
CID 106852264
2-bromo-N-(4-chloro-2-iodophenyl)furan-3-carboxamide
CID 106899056
N-(4-amino-2-chlorophenyl)-2-bromofuran-3-carboxamide
CID 106850739
N-(2,3-dichlorophenyl)-2-iodobenzamide
CID 1043515
2-bromo-N-[2-[(E)-N'-hydroxycarbamimidoyl]phenyl]furan-3-carboxamide
CID 106855740
2-bromo-N-(2-cyano-3-fluorophenyl)furan-3-carboxamide
CID 106852092
methyl 3-[(2-bromofuran-3-carbonyl)amino]-4-chlorobenzoate
CID 106852836
3-bromo-5-chloro-N-(2,3-dichlorophenyl)benzamide
CID 107951523
5-bromo-N-(2-bromo-3-chlorophenyl)-2-chlorobenzamide
CID 103479655
2-bromo-N-(3-methylphenyl)furan-3-carboxamide
CID 106852319
2-bromo-N-(2,6-dimethyl-3-pyridinyl)furan-3-carboxamide
CID 106854138

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide?
The IUPAC name of 2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide (CID 106852540) is 2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide.
What is the SMILES notation for 2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide?
The canonical SMILES for 2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide is O=C(Nc1cccc(Cl)c1Cl)c1ccoc1Br.
What is the InChIKey of 2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide?
The InChIKey is FSQYOEIELGEUPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6BrCl2NO2/c12-10-6(4-5-17-10)11(16)15-8-3-1-2-7(13)9(8)14/h1-5H,(H,15,16).
What are the key properties of 2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide?
2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide has a molecular weight of 334.98 g/mol, XLogP of 4.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(2,3-dichlorophenyl)furan-3-carboxamide is sourced from PubChem (CID 106852540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).