5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide

C19H15Cl2NO3 — CID 51057984

IUPAC5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccc(-c3ccc(Cl)cc3Cl)o2)cc1
InChIInChI=1S/C19H15Cl2NO3/c1-24-14-5-2-12(3-6-14)11-22-19(23)18-9-8-17(25-18)15-7-4-13(20)10-16(15)21/h2-10H,11H2,1H3,(H,22,23)
InChIKeyZQXNADABSQWMDJ-UHFFFAOYSA-N
MW376.24 g/mol
LogP5.19
Rot. Bonds5

About 5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide

5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide (PubChem CID 51057984) has the molecular formula C19H15Cl2NO3 and a molecular weight of 376.24 g/mol. Its IUPAC name is 5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide
PubChem CID51057984
Molecular FormulaC19H15Cl2NO3
Molecular Weight376.24 g/mol
Exact Mass375.04
IUPAC Name5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccc(-c3ccc(Cl)cc3Cl)o2)cc1
InChIInChI=1S/C19H15Cl2NO3/c1-24-14-5-2-12(3-6-14)11-22-19(23)18-9-8-17(25-18)15-7-4-13(20)10-16(15)21/h2-10H,11H2,1H3,(H,22,23)
InChIKeyZQXNADABSQWMDJ-UHFFFAOYSA-N
XLogP5.19
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.24
LogP ≤ 55.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide?
The IUPAC name of 5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide (CID 51057984) is 5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide.
What is the SMILES notation for 5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide?
The canonical SMILES for 5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide is COc1ccc(CNC(=O)c2ccc(-c3ccc(Cl)cc3Cl)o2)cc1.
What is the InChIKey of 5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide?
The InChIKey is ZQXNADABSQWMDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Cl2NO3/c1-24-14-5-2-12(3-6-14)11-22-19(23)18-9-8-17(25-18)15-7-4-13(20)10-16(15)21/h2-10H,11H2,1H3,(H,22,23).
What are the key properties of 5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide?
5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide has a molecular weight of 376.24 g/mol, XLogP of 5.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide is sourced from PubChem (CID 51057984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).