N-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide

C19H15ClN2O3 — CID 1090755

IUPACN-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccc(-c3ccccc3Cl)o2)cc1
InChIInChI=1S/C19H15ClN2O3/c1-12(23)21-13-6-8-14(9-7-13)22-19(24)18-11-10-17(25-18)15-4-2-3-5-16(15)20/h2-11H,1H3,(H,21,23)(H,22,24)
InChIKeyHTSZZJURMSEGPF-UHFFFAOYSA-N
MW354.79 g/mol
LogP4.81
Rot. Bonds4

About N-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide

N-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide (PubChem CID 1090755) has the molecular formula C19H15ClN2O3 and a molecular weight of 354.79 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide
PubChem CID1090755
Molecular FormulaC19H15ClN2O3
Molecular Weight354.79 g/mol
Exact Mass354.08
IUPAC NameN-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccc(-c3ccccc3Cl)o2)cc1
InChIInChI=1S/C19H15ClN2O3/c1-12(23)21-13-6-8-14(9-7-13)22-19(24)18-11-10-17(25-18)15-4-2-3-5-16(15)20/h2-11H,1H3,(H,21,23)(H,22,24)
InChIKeyHTSZZJURMSEGPF-UHFFFAOYSA-N
XLogP4.81
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.79
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide?
The IUPAC name of N-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide (CID 1090755) is N-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide.
What is the SMILES notation for N-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide?
The canonical SMILES for N-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide is CC(=O)Nc1ccc(NC(=O)c2ccc(-c3ccccc3Cl)o2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide?
The InChIKey is HTSZZJURMSEGPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN2O3/c1-12(23)21-13-6-8-14(9-7-13)22-19(24)18-11-10-17(25-18)15-4-2-3-5-16(15)20/h2-11H,1H3,(H,21,23)(H,22,24).
What are the key properties of N-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide?
N-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide has a molecular weight of 354.79 g/mol, XLogP of 4.81, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-5-(2-chlorophenyl)furan-2-carboxamide is sourced from PubChem (CID 1090755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).