5-bromo-N-(4-phenylphenyl)furan-2-carboxamide

C17H12BrNO2 — CID 6624475

IUPAC5-bromo-N-(4-phenylphenyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(-c2ccccc2)cc1)c1ccc(Br)o1
InChIInChI=1S/C17H12BrNO2/c18-16-11-10-15(21-16)17(20)19-14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-11H,(H,19,20)
InChIKeyNPTVOIPVCDXQEW-UHFFFAOYSA-N
MW342.19 g/mol
LogP4.96
Rot. Bonds3

About 5-bromo-N-(4-phenylphenyl)furan-2-carboxamide

5-bromo-N-(4-phenylphenyl)furan-2-carboxamide (PubChem CID 6624475) has the molecular formula C17H12BrNO2 and a molecular weight of 342.19 g/mol. Its IUPAC name is 5-bromo-N-(4-phenylphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(4-phenylphenyl)furan-2-carboxamide
PubChem CID6624475
Molecular FormulaC17H12BrNO2
Molecular Weight342.19 g/mol
Exact Mass341.01
IUPAC Name5-bromo-N-(4-phenylphenyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(-c2ccccc2)cc1)c1ccc(Br)o1
InChIInChI=1S/C17H12BrNO2/c18-16-11-10-15(21-16)17(20)19-14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-11H,(H,19,20)
InChIKeyNPTVOIPVCDXQEW-UHFFFAOYSA-N
XLogP4.96
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.19
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-(4-phenyldiazenylphenyl)furan-2-carboxamide
CID 3406026
5-bromo-N-(4-hydroxyphenyl)furan-2-carboxamide
CID 973213
5-bromo-N-[4-(bromomethyl)phenyl]furan-2-carboxamide
CID 114310818
5-bromo-N-(2-phenylphenyl)furan-2-carboxamide
CID 2183264
5-bromo-N-[3-[(5-bromofuran-2-carbonyl)amino]phenyl]furan-2-carboxamide
CID 3460668
1-[4-[(5-bromofuran-2-carbonyl)amino]phenyl]cyclopropane-1-carboxylic acid
CID 115912857
5-bromo-N-[4-(6-bromo-4-phenylquinolin-2-yl)phenyl]furan-2-carboxamide
CID 3098585
5-bromo-N-[4-(1H-indol-2-yl)phenyl]furan-2-carboxamide
CID 46334471
5-bromo-N-[4-(1-methylbenzimidazol-2-yl)phenyl]furan-2-carboxamide
CID 51135396
5-bromo-N-[4-(methylsulfamoyl)phenyl]furan-2-carboxamide
CID 2989629
5-bromo-N-[4-(diethylamino)phenyl]furan-2-carboxamide
CID 738269
5-bromo-N-[4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide
CID 1047401

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(4-phenylphenyl)furan-2-carboxamide?
The IUPAC name of 5-bromo-N-(4-phenylphenyl)furan-2-carboxamide (CID 6624475) is 5-bromo-N-(4-phenylphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(4-phenylphenyl)furan-2-carboxamide?
The canonical SMILES for 5-bromo-N-(4-phenylphenyl)furan-2-carboxamide is O=C(Nc1ccc(-c2ccccc2)cc1)c1ccc(Br)o1.
What is the InChIKey of 5-bromo-N-(4-phenylphenyl)furan-2-carboxamide?
The InChIKey is NPTVOIPVCDXQEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12BrNO2/c18-16-11-10-15(21-16)17(20)19-14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-11H,(H,19,20).
What are the key properties of 5-bromo-N-(4-phenylphenyl)furan-2-carboxamide?
5-bromo-N-(4-phenylphenyl)furan-2-carboxamide has a molecular weight of 342.19 g/mol, XLogP of 4.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(4-phenylphenyl)furan-2-carboxamide is sourced from PubChem (CID 6624475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).