5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide

C19H16ClNO4 — CID 3393060

IUPAC5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(-c3ccc(Cl)cc3)o2)c1
InChIInChI=1S/C19H16ClNO4/c1-23-14-7-8-17(24-2)15(11-14)21-19(22)18-10-9-16(25-18)12-3-5-13(20)6-4-12/h3-11H,1-2H3,(H,21,22)
InChIKeyGMPHMTFERVOCRI-UHFFFAOYSA-N
MW357.79 g/mol
LogP4.87
Rot. Bonds5

About 5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide

5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide (PubChem CID 3393060) has the molecular formula C19H16ClNO4 and a molecular weight of 357.79 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide
PubChem CID3393060
Molecular FormulaC19H16ClNO4
Molecular Weight357.79 g/mol
Exact Mass357.08
IUPAC Name5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(-c3ccc(Cl)cc3)o2)c1
InChIInChI=1S/C19H16ClNO4/c1-23-14-7-8-17(24-2)15(11-14)21-19(22)18-10-9-16(25-18)12-3-5-13(20)6-4-12/h3-11H,1-2H3,(H,21,22)
InChIKeyGMPHMTFERVOCRI-UHFFFAOYSA-N
XLogP4.87
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.79
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide?
The IUPAC name of 5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide (CID 3393060) is 5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide?
The canonical SMILES for 5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide is COc1ccc(OC)c(NC(=O)c2ccc(-c3ccc(Cl)cc3)o2)c1.
What is the InChIKey of 5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide?
The InChIKey is GMPHMTFERVOCRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClNO4/c1-23-14-7-8-17(24-2)15(11-14)21-19(22)18-10-9-16(25-18)12-3-5-13(20)6-4-12/h3-11H,1-2H3,(H,21,22).
What are the key properties of 5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide?
5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide has a molecular weight of 357.79 g/mol, XLogP of 4.87, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide is sourced from PubChem (CID 3393060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).